AB00115619-01
TL;DR: AB00115619-01 (CAS 381708-81-2) is a chemical compound with molecular formula C22H19N3O3S and molecular weight 405.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[(E)-1-(1H-benzimidazol-2-yl)-2-(3,4-dimethoxyphenyl)ethenyl]thiophene-2-carboxamide
Also Known As: AB00115619-01, N-[(E)-1-(1H-benzimidazol-2-yl)-2-(3,4-dimethoxyphenyl)ethenyl]thiophene-2-carboxamide, (E)-N-(1-(1H-benzo[d]imidazol-2-yl)-2-(3,4-dimethoxyphenyl)vinyl)thiophene-2-carboxamide
| Molecular Formula | C22H19N3O3S |
|---|---|
| Molecular Weight | 405.11 g/mol |
| LogP | 4.5697 |
| Topological Polar Surface Area | 76.24 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 405.11472 |
| Heavy Atoms | 29 |
| Complexity | 1146.2208 |
Chemical Identifiers
| CAS Number | 381708-81-2 |
|---|---|
| SMILES | COC1=C(C=C(C=C1)/C=C(\C2=NC3=CC=CC=C3N2)/NC(=O)C4=CC=CS4)OC |
Product Overview
AB00115619-01 (CAS 381708-81-2), with molecular formula C22H19N3O3S and molecular weight 405.11 g/mol. IUPAC: N-[(E)-1-(1H-benzimidazol-2-yl)-2-(3,4-dimethoxyphenyl)ethenyl]thiophene-2-carboxamide.
Chemical Property Profile of AB00115619-01
Property Insights of AB00115619-01
The XLogP value of 4.5697 indicates that AB00115619-01 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 76.24 Ų falls within the moderate polarity range, balancing permeability and solubility for AB00115619-01. Following Lipinski's Rule of Five, AB00115619-01 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
Frequently Asked Questions
What is the CAS number of AB00115619-01?
The CAS number of AB00115619-01 is 381708-81-2.
What is the molecular formula of AB00115619-01?
The molecular formula of AB00115619-01 is C22H19N3O3S.
What is the molecular weight of AB00115619-01?
The molecular weight of AB00115619-01 is 405.11 g/mol.
Where can I buy AB00115619-01?
You can request a quote for AB00115619-01 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AB00115619-01?
Yes, KEHONG BIO provides custom synthesis services for AB00115619-01 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.