BAS 10214747
TL;DR: BAS 10214747 (CAS 831187-48-5) is a chemical compound with molecular formula C19H17N3O3S and molecular weight 367.10 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-(2-oxo-1,3-benzoxazol-3-yl)propanamide
Also Known As: BAS 10214747, N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-3-(2-oxo-1,3-benzoxazol-3(2H)-yl)propanamide, N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-3-(2-oxo-1,3-benzoxazol-3-yl)propanamide, N-(3-cyano-4,5,6,7-tetrahydrobenzo[b]thiophen-2-yl)-3-(2-oxobenzo[d]oxazol-3(2H)-yl)propanamide
| Molecular Formula | C19H17N3O3S |
|---|---|
| Molecular Weight | 367.10 g/mol |
| LogP | 3.43528 |
| Topological Polar Surface Area | 88.03 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 367.09906 |
| Heavy Atoms | 26 |
| Complexity | 1083.8185 |
Chemical Identifiers
| CAS Number | 831187-48-5 |
|---|---|
| SMILES | C1CCC2=C(C1)C(=C(S2)NC(=O)CCN3C4=CC=CC=C4OC3=O)C#N |
Product Overview
BAS 10214747 (CAS 831187-48-5), with molecular formula C19H17N3O3S and molecular weight 367.10 g/mol. IUPAC: N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-3-(2-oxo-1,3-benzoxazol-3-yl)propanamide.
Chemical Property Profile of BAS 10214747
Property Insights of BAS 10214747
The XLogP value of 3.43528 indicates that BAS 10214747 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 88.03 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 10214747. Following Lipinski's Rule of Five, BAS 10214747 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 10214747?
The CAS number of BAS 10214747 is 831187-48-5.
What is the molecular formula of BAS 10214747?
The molecular formula of BAS 10214747 is C19H17N3O3S.
What is the molecular weight of BAS 10214747?
The molecular weight of BAS 10214747 is 367.10 g/mol.
Where can I buy BAS 10214747?
You can request a quote for BAS 10214747 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 10214747?
Yes, KEHONG BIO provides custom synthesis services for BAS 10214747 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.