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3H-Imidazo(2,1-b)(3)benzazepine, 2,5,6,11-tetrahydro-, sulfate (1:1) structure
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3H-Imidazo(2,1-b)(3)benzazepine, 2,5,6,11-tetrahydro-, sulfate (1:1)

TL;DR: 3H-Imidazo(2,1-b)(3)benzazepine, 2,5,6,11-tetrahydro-, sulfate (1:1) (CAS 121771-84-4) is a chemical compound with molecular formula C12H16N2O4S and molecular weight 284.08307 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

sulfuric acid;3,5,6,11-tetrahydro-2H-imidazo[1,2-c][3]benzazepine

Also Known As: 3H-Imidazo(2,1-b)(3)benzazepine, 2,5,6,11-tetrahydro-, sulfate (1:1), 2,5,6,11-Tetrahydro-3H-imidazo(2,1-b)(3)benzazepine sulfate, 2,5,6,11-Tetrahydro-3H-imidazo(2,1-b)(3)benzazepin-1-ium hydrogensulfat [German], 2,5,6,11-Tetrahydro-3H-imidazo(2,1-b)(3)benzazepin-1-ium hydrogensulfat, 3H-Imidazo(2,1-b)(3)benzazepine,2,5,6,11-tetrahydro-,sulfate (1:1)

CAS Number
121771-84-4
Molecular Formula
C12H16N2O4S
Molecular Weight
284.08307 g/mol
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Technical Specifications

Molecular FormulaC12H16N2O4S
Molecular Weight284.08307 g/mol
XLogP0.8465
Topological Polar Surface Area (TPSA)98.6 Ų
Hydrogen Bond Donors2
Hydrogen Bond Acceptors5
Rotatable Bonds0
Exact Mass284.08307 Da
Heavy Atoms19
Complexity328.0
SMILESC1CN2CCN=C2CC3=CC=CC=C31.OS(=O)(=O)O
InChIKeyNBCVSDLMPWFYBF-UHFFFAOYSA-N

Chemical Property Profile of 3H-Imidazo(2,1-b)(3)benzazepine, 2,5,6,11-tetrahydro-, sulfate (1:1)

XLogP
0.8465
TPSA (Topological Polar Surface Area)
98.6
Hydrogen Bond Donors
2
Hydrogen Bond Acceptors
5
Rotatable Bonds
0
Heavy Atoms
19
Complexity
328.0
Exact Mass
284.08307
Monoisotopic Mass
284.08307
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 3H-Imidazo(2,1-b)(3)benzazepine, 2,5,6,11-tetrahydro-, sulfate (1:1)

The XLogP value of 0.8465 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3H-Imidazo(2,1-b)(3)benzazepine, 2,5,6,11-tetrahydro-, sulfate (1:1). The TPSA of 98.6 Ų falls within the moderate polarity range, balancing permeability and solubility for 3H-Imidazo(2,1-b)(3)benzazepine, 2,5,6,11-tetrahydro-, sulfate (1:1). Following Lipinski's Rule of Five, 3H-Imidazo(2,1-b)(3)benzazepine, 2,5,6,11-tetrahydro-, sulfate (1:1) 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 3H-Imidazo(2,1-b)(3)benzazepine, 2,5,6,11-tetrahydro-, sulfate (1:1)?

The CAS number of 3H-Imidazo(2,1-b)(3)benzazepine, 2,5,6,11-tetrahydro-, sulfate (1:1) is 121771-84-4.

What is the molecular formula of 3H-Imidazo(2,1-b)(3)benzazepine, 2,5,6,11-tetrahydro-, sulfate (1:1)?

The molecular formula of 3H-Imidazo(2,1-b)(3)benzazepine, 2,5,6,11-tetrahydro-, sulfate (1:1) is C12H16N2O4S.

What is the molecular weight of 3H-Imidazo(2,1-b)(3)benzazepine, 2,5,6,11-tetrahydro-, sulfate (1:1)?

The molecular weight of 3H-Imidazo(2,1-b)(3)benzazepine, 2,5,6,11-tetrahydro-, sulfate (1:1) is 284.08307 g/mol.

Where can I buy 3H-Imidazo(2,1-b)(3)benzazepine, 2,5,6,11-tetrahydro-, sulfate (1:1)?

You can request a quote for 3H-Imidazo(2,1-b)(3)benzazepine, 2,5,6,11-tetrahydro-, sulfate (1:1) directly from CoreyChem. Contact us or email [email protected] for pricing and availability.

Does CoreyChem offer custom synthesis for 3H-Imidazo(2,1-b)(3)benzazepine, 2,5,6,11-tetrahydro-, sulfate (1:1)?

Yes, CoreyChem provides custom synthesis services for 3H-Imidazo(2,1-b)(3)benzazepine, 2,5,6,11-tetrahydro-, sulfate (1:1) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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