BAS 07004904
TL;DR: BAS 07004904 (CAS 477494-03-4) is a chemical compound with molecular formula C18H20N2O3S and molecular weight 344.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(3-methoxybenzoyl)amino]-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carboxamide
Also Known As: BAS 07004904, 2-(3-methoxybenzamido)-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carboxamide, AB00672564-01, F0806-0362, 2-(3-METHOXYBENZAMIDO)-4H,5H,6H,7H,8H-CYCLOHEPTA[B]THIOPHENE-3-CARBOXAMIDE
| Molecular Formula | C18H20N2O3S |
|---|---|
| Molecular Weight | 344.12 g/mol |
| LogP | 3.3768 |
| Topological Polar Surface Area | 81.42 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 344.11948 |
| Heavy Atoms | 24 |
| Complexity | 782.5662 |
Chemical Identifiers
| CAS Number | 477494-03-4 |
|---|---|
| SMILES | COC1=CC=CC(=C1)C(=O)NC2=C(C3=C(S2)CCCCC3)C(=O)N |
Product Overview
BAS 07004904 (CAS 477494-03-4), with molecular formula C18H20N2O3S and molecular weight 344.12 g/mol. IUPAC: 2-[(3-methoxybenzoyl)amino]-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carboxamide.
Chemical Property Profile of BAS 07004904
Property Insights of BAS 07004904
The XLogP value of 3.3768 indicates that BAS 07004904 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 81.42 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 07004904. Following Lipinski's Rule of Five, BAS 07004904 has 2 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 07004904?
The CAS number of BAS 07004904 is 477494-03-4.
What is the molecular formula of BAS 07004904?
The molecular formula of BAS 07004904 is C18H20N2O3S.
What is the molecular weight of BAS 07004904?
The molecular weight of BAS 07004904 is 344.12 g/mol.
Where can I buy BAS 07004904?
You can request a quote for BAS 07004904 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 07004904?
Yes, KEHONG BIO provides custom synthesis services for BAS 07004904 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.