BAS 00329538
TL;DR: BAS 00329538 (CAS 331001-48-0) is a chemical compound with molecular formula C18H15ClN2O3S and molecular weight 374.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-chloro-N-[(E)-(3,4-dimethoxyphenyl)methylideneamino]-1-benzothiophene-2-carboxamide
Also Known As: BAS 00329538, 3-chloro-N'-(3,4-dimethoxybenzylidene)-1-benzo[b]thiophene-2-carbohydrazide, 3-chloro-N-[(E)-(3,4-dimethoxyphenyl)methylideneamino]-1-benzothiophene-2-carboxamide, 3-chloro-N'-[(E)-(3,4-dimethoxyphenyl)methylidene]-1-benzothiophene-2-carbohydrazide
| Molecular Formula | C18H15ClN2O3S |
|---|---|
| Molecular Weight | 374.05 g/mol |
| LogP | 4.3358 |
| Topological Polar Surface Area | 59.92 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 374.0492 |
| Heavy Atoms | 25 |
| Complexity | 952.6442 |
Chemical Identifiers
| CAS Number | 331001-48-0 |
|---|---|
| SMILES | COC1=C(C=C(C=C1)/C=N/NC(=O)C2=C(C3=CC=CC=C3S2)Cl)OC |
Product Overview
BAS 00329538 (CAS 331001-48-0), with molecular formula C18H15ClN2O3S and molecular weight 374.05 g/mol. IUPAC: 3-chloro-N-[(E)-(3,4-dimethoxyphenyl)methylideneamino]-1-benzothiophene-2-carboxamide.
Chemical Property Profile of BAS 00329538
Property Insights of BAS 00329538
The XLogP value of 4.3358 indicates that BAS 00329538 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 59.92 Ų, BAS 00329538 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, BAS 00329538 has 1 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 BAS 00329538?
The CAS number of BAS 00329538 is 331001-48-0.
What is the molecular formula of BAS 00329538?
The molecular formula of BAS 00329538 is C18H15ClN2O3S.
What is the molecular weight of BAS 00329538?
The molecular weight of BAS 00329538 is 374.05 g/mol.
Where can I buy BAS 00329538?
You can request a quote for BAS 00329538 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 00329538?
Yes, KEHONG BIO provides custom synthesis services for BAS 00329538 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.