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2,10,12-triaza-9-(6-chloro-2-fluorophenyl)-5,5-dimethyltricyclo[9.4.0.0<3,8>]pentadeca-1(15),3(8),11(12),13-tetraen-7-one structure
Fine Chemical

2,10,12-triaza-9-(6-chloro-2-fluorophenyl)-5,5-dimethyltricyclo[9.4.0.0<3,8>]pentadeca-1(15),3(8),11(12),13-tetraen-7-one

TL;DR: 2,10,12-triaza-9-(6-chloro-2-fluorophenyl)-5,5-dimethyltricyclo[9.4.0.0<3,8>]pentadeca-1(15),3(8),11(12),13-tetraen-7-one (CAS 1022505-60-7) is a chemical compound with molecular formula C20H19ClFN3O and molecular weight 371.12006 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

6-(2-chloro-6-fluorophenyl)-9,9-dimethyl-6,8,10,11-tetrahydro-5H-pyrido[3,2-b][1,4]benzodiazepin-7-one

Also Known As: 2,10,12-triaza-9-(6-chloro-2-fluorophenyl)-5,5-dimethyltricyclo[9.4.0.0<3,8>]pentadeca-1(15),3(8),11(12),13-tetraen-7-one, 6-(2-chloro-6-fluorophenyl)-9,9-dimethyl-6,8,10,11-tetrahydro-5H-pyrido[3,2-b][1,4]benzodiazepin-7-one, 10-(2-chloro-6-fluorophenyl)-14,14-dimethyl-2,7,9-triazatricyclo[9.4.0.0^{3,8}]pentadeca-1(11),3,5,7-tetraen-12-one, 6-(2-chloro-6-fluoro-phenyl)-9,9-dimethyl-6,8,10,11-tetrahydro-5H-pyrido[3,2-b][1,4]benzodiazepin-7-one, C20H19ClFN3O

CAS Number
1022505-60-7
Molecular Formula
C20H19ClFN3O
Molecular Weight
371.12006 g/mol
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Technical Specifications

Molecular FormulaC20H19ClFN3O
Molecular Weight371.12006 g/mol
XLogP4.2
Topological Polar Surface Area (TPSA)54.0 Ų
Hydrogen Bond Donors2
Hydrogen Bond Acceptors5
Rotatable Bonds1
Exact Mass371.12006 Da
Heavy Atoms26
Complexity608.0
SMILESCC1(CC2=C(C(NC3=C(N2)C=CC=N3)C4=C(C=CC=C4Cl)F)C(=O)C1)C
InChIKeyJZIBEWSPFWNQSX-UHFFFAOYSA-N

Chemical Property Profile of 2,10,12-triaza-9-(6-chloro-2-fluorophenyl)-5,5-dimethyltricyclo[9.4.0.0<3,8>]pentadeca-1(15),3(8),11(12),13-tetraen-7-one

XLogP
4.2
TPSA (Topological Polar Surface Area)
54.0
Hydrogen Bond Donors
2
Hydrogen Bond Acceptors
5
Rotatable Bonds
1
Heavy Atoms
26
Complexity
608.0
Exact Mass
371.12006
Monoisotopic Mass
371.12006
Data Source: Chemical property values are referenced from PubChem, the world's largest open chemistry database maintained by the National Center for Biotechnology Information (NCBI), U.S. National Library of Medicine.

Property Insights of 2,10,12-triaza-9-(6-chloro-2-fluorophenyl)-5,5-dimethyltricyclo[9.4.0.0<3,8>]pentadeca-1(15),3(8),11(12),13-tetraen-7-one

The XLogP value of 4.2 indicates that 2,10,12-triaza-9-(6-chloro-2-fluorophenyl)-5,5-dimethyltricyclo[9.4.0.0<3,8>]pentadeca-1(15),3(8),11(12),13-tetraen-7-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 54.0 Ų, 2,10,12-triaza-9-(6-chloro-2-fluorophenyl)-5,5-dimethyltricyclo[9.4.0.0<3,8>]pentadeca-1(15),3(8),11(12),13-tetraen-7-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2,10,12-triaza-9-(6-chloro-2-fluorophenyl)-5,5-dimethyltricyclo[9.4.0.0<3,8>]pentadeca-1(15),3(8),11(12),13-tetraen-7-one has 2 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.

Frequently Asked Questions

What is the CAS number of 2,10,12-triaza-9-(6-chloro-2-fluorophenyl)-5,5-dimethyltricyclo[9.4.0.0<3,8>]pentadeca-1(15),3(8),11(12),13-tetraen-7-one?

The CAS number of 2,10,12-triaza-9-(6-chloro-2-fluorophenyl)-5,5-dimethyltricyclo[9.4.0.0<3,8>]pentadeca-1(15),3(8),11(12),13-tetraen-7-one is 1022505-60-7.

What is the molecular formula of 2,10,12-triaza-9-(6-chloro-2-fluorophenyl)-5,5-dimethyltricyclo[9.4.0.0<3,8>]pentadeca-1(15),3(8),11(12),13-tetraen-7-one?

The molecular formula of 2,10,12-triaza-9-(6-chloro-2-fluorophenyl)-5,5-dimethyltricyclo[9.4.0.0<3,8>]pentadeca-1(15),3(8),11(12),13-tetraen-7-one is C20H19ClFN3O.

What is the molecular weight of 2,10,12-triaza-9-(6-chloro-2-fluorophenyl)-5,5-dimethyltricyclo[9.4.0.0<3,8>]pentadeca-1(15),3(8),11(12),13-tetraen-7-one?

The molecular weight of 2,10,12-triaza-9-(6-chloro-2-fluorophenyl)-5,5-dimethyltricyclo[9.4.0.0<3,8>]pentadeca-1(15),3(8),11(12),13-tetraen-7-one is 371.12006 g/mol.

Where can I buy 2,10,12-triaza-9-(6-chloro-2-fluorophenyl)-5,5-dimethyltricyclo[9.4.0.0<3,8>]pentadeca-1(15),3(8),11(12),13-tetraen-7-one?

You can request a quote for 2,10,12-triaza-9-(6-chloro-2-fluorophenyl)-5,5-dimethyltricyclo[9.4.0.0<3,8>]pentadeca-1(15),3(8),11(12),13-tetraen-7-one directly from CoreyChem. Contact us or email [email protected] for pricing and availability.

Does CoreyChem offer custom synthesis for 2,10,12-triaza-9-(6-chloro-2-fluorophenyl)-5,5-dimethyltricyclo[9.4.0.0<3,8>]pentadeca-1(15),3(8),11(12),13-tetraen-7-one?

Yes, CoreyChem provides custom synthesis services for 2,10,12-triaza-9-(6-chloro-2-fluorophenyl)-5,5-dimethyltricyclo[9.4.0.0<3,8>]pentadeca-1(15),3(8),11(12),13-tetraen-7-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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