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RefChem:1058544 structure
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RefChem:1058544

TL;DR: RefChem:1058544 (CAS 133662-14-3) is a chemical compound with molecular formula C15H16ClN3O and molecular weight 289.09818 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

N-[(E)-1-(2-chlorophenyl)ethylideneamino]-1,5-dimethylpyrrole-2-carboxamide

Also Known As: (E)-1,5-Dimethyl-1H-pyrrole-2-carboxylic acid (1-(2-chlorophenyl)ethylidene)hydrazide, 1H-Pyrrole-2-carboxylic acid, 1,5-dimethyl-, (1-(2-chlorophenyl)ethylidene)hydrazide, (E)-, N -(alpha-Methyl-2-chlorobenzylidene)-1,5-dimethyl-1H-pyrrole-2-carbohydrazide, N'-[1-(2-chlorophenyl)ethylidene]-1,5-dimethyl-1H-pyrrole-2-carbohydrazide, BRN 4261651

CAS Number
133662-14-3
Molecular Formula
C15H16ClN3O
Molecular Weight
289.09818 g/mol
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Technical Specifications

Molecular FormulaC15H16ClN3O
Molecular Weight289.09818 g/mol
XLogP3.2
Topological Polar Surface Area (TPSA)46.4 Ų
Hydrogen Bond Donors1
Hydrogen Bond Acceptors2
Rotatable Bonds3
Exact Mass289.09818 Da
Heavy Atoms20
Complexity385.0
SMILESCC1=CC=C(N1C)C(=O)N/N=C(\C)/C2=CC=CC=C2Cl
InChIKeyVLFGAFRBUKDEGS-GZTJUZNOSA-N

Chemical Property Profile of RefChem:1058544

XLogP
3.2
TPSA (Topological Polar Surface Area)
46.4
Hydrogen Bond Donors
1
Hydrogen Bond Acceptors
2
Rotatable Bonds
3
Heavy Atoms
20
Complexity
385.0
Exact Mass
289.09818
Monoisotopic Mass
289.09818
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 RefChem:1058544

The XLogP value of 3.2 indicates that RefChem:1058544 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 46.4 Ų, RefChem:1058544 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, RefChem:1058544 has 1 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.

Frequently Asked Questions

What is the CAS number of RefChem:1058544?

The CAS number of RefChem:1058544 is 133662-14-3.

What is the molecular formula of RefChem:1058544?

The molecular formula of RefChem:1058544 is C15H16ClN3O.

What is the molecular weight of RefChem:1058544?

The molecular weight of RefChem:1058544 is 289.09818 g/mol.

Where can I buy RefChem:1058544?

You can request a quote for RefChem:1058544 directly from CoreyChem. Contact us or email [email protected] for pricing and availability.

Does CoreyChem offer custom synthesis for RefChem:1058544?

Yes, CoreyChem provides custom synthesis services for RefChem:1058544 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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