AB00673718-01
TL;DR: AB00673718-01 (CAS 799776-61-7) is a chemical compound with molecular formula C21H14N6O4S3 and molecular weight 510.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[[(E)-2-cyano-2-[4-(3-nitrophenyl)-1,3-thiazol-2-yl]ethenyl]amino]-N-(1,3-thiazol-2-yl)benzenesulfonamide
Also Known As: AB00673718-01, F1291-0386, (E)-4-((2-cyano-2-(4-(3-nitrophenyl)thiazol-2-yl)vinyl)amino)-N-(thiazol-2-yl)benzenesulfonamide, 4-[[(E)-2-cyano-2-[4-(3-nitrophenyl)-1,3-thiazol-2-yl]ethenyl]amino]-N-(1,3-thiazol-2-yl)benzenesulfonamide, 4-{[(1E)-2-cyano-2-[4-(3-nitrophenyl)-1,3-thiazol-2-yl]eth-1-en-1-yl]amino}-N-(1,3-thiazol-2-yl)benzene-1-sulfonamide
| Molecular Formula | C21H14N6O4S3 |
|---|---|
| Molecular Weight | 510.02 g/mol |
| LogP | 4.95218 |
| Topological Polar Surface Area | 150.91 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 8 |
| Exact Mass | 510.02386 |
| Heavy Atoms | 34 |
| Complexity | 1504.5912 |
Chemical Identifiers
| CAS Number | 799776-61-7 |
|---|---|
| SMILES | C1=CC(=CC(=C1)[N+](=O)[O-])C2=CSC(=N2)/C(=C/NC3=CC=C(C=C3)S(=O)(=O)NC4=NC=CS4)/C#N |
Product Overview
AB00673718-01 (CAS 799776-61-7), with molecular formula C21H14N6O4S3 and molecular weight 510.02 g/mol. IUPAC: 4-[[(E)-2-cyano-2-[4-(3-nitrophenyl)-1,3-thiazol-2-yl]ethenyl]amino]-N-(1,3-thiazol-2-yl)benzenesulfonamide.
Chemical Property Profile of AB00673718-01
Property Insights of AB00673718-01
The XLogP value of 4.95218 indicates that AB00673718-01 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 150.91 Ų indicates high polarity, suggesting AB00673718-01 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, AB00673718-01 has 2 hydrogen bond donor(s) and 10 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of AB00673718-01?
The CAS number of AB00673718-01 is 799776-61-7.
What is the molecular formula of AB00673718-01?
The molecular formula of AB00673718-01 is C21H14N6O4S3.
What is the molecular weight of AB00673718-01?
The molecular weight of AB00673718-01 is 510.02 g/mol.
Where can I buy AB00673718-01?
You can request a quote for AB00673718-01 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AB00673718-01?
Yes, KEHONG BIO provides custom synthesis services for AB00673718-01 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.