BAS 00791722
TL;DR: BAS 00791722 (CAS 303056-90-8) is a chemical compound with molecular formula C18H11N3O4S2 and molecular weight 397.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-hydroxy-N-[4-hydroxy-5-(2-oxoindol-3-yl)-2-sulfanylidene-1,3-thiazol-3-yl]benzamide
Also Known As: BAS 00791722, 3-hydroxy-N-[(5Z)-4-oxo-5-(2-oxo-1H-indol-3-ylidene)-2-sulfanylidene-1,3-thiazolidin-3-yl]benzamide, 3-hydroxy-N-[(5Z)-4-keto-5-(2-ketoindolin-3-ylidene)-2-thioxo-thiazolidin-3-yl]benzamide, 3-hydroxy-N-[4-hydroxy-5-(2-oxoindol-3-yl)-2-sulfanylidene-1,3-thiazol-3-yl]benzamide, 3-hydroxy-N-[(5E)-4-oxo-5-(2-oxo-1H-indol-3-ylidene)-2-sulfanylidene-1,3-thiazolidin-3-yl]benzamide
| Molecular Formula | C18H11N3O4S2 |
|---|---|
| Molecular Weight | 397.02 g/mol |
| LogP | 1.43299 |
| Topological Polar Surface Area | 103.92 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Exact Mass | 397.0191 |
| Heavy Atoms | 27 |
| Complexity | 1290.4209 |
Chemical Identifiers
| CAS Number | 303056-90-8 |
|---|---|
| SMILES | C1=CC2=C(C(=O)N=C2C=C1)C3=C(N(C(=S)S3)NC(=O)C4=CC(=CC=C4)O)O |
Product Overview
BAS 00791722 (CAS 303056-90-8), with molecular formula C18H11N3O4S2 and molecular weight 397.02 g/mol. IUPAC: 3-hydroxy-N-[4-hydroxy-5-(2-oxoindol-3-yl)-2-sulfanylidene-1,3-thiazol-3-yl]benzamide.
Chemical Property Profile of BAS 00791722
Property Insights of BAS 00791722
The XLogP value of 1.43299 suggests moderate lipophilicity, balancing water solubility and membrane permeability for BAS 00791722. The TPSA of 103.92 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 00791722. Following Lipinski's Rule of Five, BAS 00791722 has 3 hydrogen bond donor(s) and 6 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 00791722?
The CAS number of BAS 00791722 is 303056-90-8.
What is the molecular formula of BAS 00791722?
The molecular formula of BAS 00791722 is C18H11N3O4S2.
What is the molecular weight of BAS 00791722?
The molecular weight of BAS 00791722 is 397.02 g/mol.
Where can I buy BAS 00791722?
You can request a quote for BAS 00791722 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 00791722?
Yes, KEHONG BIO provides custom synthesis services for BAS 00791722 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.