BAS 04435647
TL;DR: BAS 04435647 (CAS 305852-23-7) is a chemical compound with molecular formula C21H18N2O2S and molecular weight 362.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-3-methoxynaphthalene-2-carboxamide
Also Known As: BAS 04435647, N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-3-methoxynaphthalene-2-carboxamide, F0016-0368, N-(3-cyano-4,5,6,7-tetrahydrobenzo[b]thiophen-2-yl)-3-methoxy-2-naphthamide, N-(3-cyano(4,5,6,7-tetrahydrobenzo[b]thiophen-2-yl))(3-methoxy(2-naphthyl))car boxamide
| Molecular Formula | C21H18N2O2S |
|---|---|
| Molecular Weight | 362.11 g/mol |
| LogP | 4.91268 |
| Topological Polar Surface Area | 62.12 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 362.1089 |
| Heavy Atoms | 26 |
| Complexity | 1046.081 |
Chemical Identifiers
| CAS Number | 305852-23-7 |
|---|---|
| SMILES | COC1=CC2=CC=CC=C2C=C1C(=O)NC3=C(C4=C(S3)CCCC4)C#N |
Product Overview
BAS 04435647 (CAS 305852-23-7), with molecular formula C21H18N2O2S and molecular weight 362.11 g/mol. IUPAC: N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-3-methoxynaphthalene-2-carboxamide.
Chemical Property Profile of BAS 04435647
Property Insights of BAS 04435647
The XLogP value of 4.91268 indicates that BAS 04435647 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 62.12 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 04435647. Following Lipinski's Rule of Five, BAS 04435647 has 1 hydrogen bond donor(s) and 4 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 04435647?
The CAS number of BAS 04435647 is 305852-23-7.
What is the molecular formula of BAS 04435647?
The molecular formula of BAS 04435647 is C21H18N2O2S.
What is the molecular weight of BAS 04435647?
The molecular weight of BAS 04435647 is 362.11 g/mol.
Where can I buy BAS 04435647?
You can request a quote for BAS 04435647 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 04435647?
Yes, KEHONG BIO provides custom synthesis services for BAS 04435647 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.