BAS 09790352
TL;DR: BAS 09790352 (CAS 876711-74-9) is a chemical compound with molecular formula C19H18N2O3S and molecular weight 354.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[1-(2-anilino-2-oxoethyl)-5-thiophen-2-ylpyrrol-2-yl]propanoic acid
Also Known As: BAS 09790352, 3-(1-Phenylcarbamoylmethyl-5-thiophen-2-yl-1H-pyrrol-2-yl)-propionic acid, 3-[1-(2-anilino-2-oxoethyl)-5-thiophen-2-ylpyrrol-2-yl]propanoic acid, 3-(1-(2-oxo-2-(phenylamino)ethyl)-5-(thiophen-2-yl)-1H-pyrrol-2-yl)propanoic acid, 3-{1-[(PHENYLCARBAMOYL)METHYL]-5-(THIOPHEN-2-YL)-1H-PYRROL-2-YL}PROPANOIC ACID
| Molecular Formula | C19H18N2O3S |
|---|---|
| Molecular Weight | 354.10 g/mol |
| LogP | 3.8725 |
| Topological Polar Surface Area | 71.33 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 7 |
| Exact Mass | 354.10382 |
| Heavy Atoms | 25 |
| Complexity | 854.1938 |
Chemical Identifiers
| CAS Number | 876711-74-9 |
|---|---|
| SMILES | C1=CC=C(C=C1)NC(=O)CN2C(=CC=C2C3=CC=CS3)CCC(=O)O |
Product Overview
BAS 09790352 (CAS 876711-74-9), with molecular formula C19H18N2O3S and molecular weight 354.10 g/mol. IUPAC: 3-[1-(2-anilino-2-oxoethyl)-5-thiophen-2-ylpyrrol-2-yl]propanoic acid.
Chemical Property Profile of BAS 09790352
Property Insights of BAS 09790352
The XLogP value of 3.8725 indicates that BAS 09790352 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 71.33 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 09790352. Following Lipinski's Rule of Five, BAS 09790352 has 2 hydrogen bond donor(s) and 3 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 09790352?
The CAS number of BAS 09790352 is 876711-74-9.
What is the molecular formula of BAS 09790352?
The molecular formula of BAS 09790352 is C19H18N2O3S.
What is the molecular weight of BAS 09790352?
The molecular weight of BAS 09790352 is 354.10 g/mol.
Where can I buy BAS 09790352?
You can request a quote for BAS 09790352 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 09790352?
Yes, KEHONG BIO provides custom synthesis services for BAS 09790352 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.