BAS 05896403
TL;DR: BAS 05896403 (CAS 799252-40-7) is a chemical compound with molecular formula C20H17N5O3S2 and molecular weight 439.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[4-[[(E)-2-cyano-2-[4-(4-methylphenyl)-1,3-thiazol-2-yl]ethenyl]amino]phenyl]sulfonylurea
Also Known As: BAS 05896403, (E)-N-carbamoyl-4-((2-cyano-2-(4-(p-tolyl)thiazol-2-yl)vinyl)amino)benzenesulfonamide, [4-[[(E)-2-cyano-2-[4-(4-methylphenyl)-1,3-thiazol-2-yl]ethenyl]amino]phenyl]sulfonylurea, N-carbamoyl-4-({(E)-2-cyano-2-[4-(4-methylphenyl)-1,3-thiazol-2-yl]ethenyl}amino)benzenesulfonamide
| Molecular Formula | C20H17N5O3S2 |
|---|---|
| Molecular Weight | 439.08 g/mol |
| LogP | 3.4521 |
| Topological Polar Surface Area | 137.97 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 6 |
| Exact Mass | 439.07727 |
| Heavy Atoms | 30 |
| Complexity | 1238.8441 |
Chemical Identifiers
| CAS Number | 799252-40-7 |
|---|---|
| SMILES | CC1=CC=C(C=C1)C2=CSC(=N2)/C(=C/NC3=CC=C(C=C3)S(=O)(=O)NC(=O)N)/C#N |
Product Overview
BAS 05896403 (CAS 799252-40-7), with molecular formula C20H17N5O3S2 and molecular weight 439.08 g/mol. IUPAC: [4-[[(E)-2-cyano-2-[4-(4-methylphenyl)-1,3-thiazol-2-yl]ethenyl]amino]phenyl]sulfonylurea.
Chemical Property Profile of BAS 05896403
Property Insights of BAS 05896403
The XLogP value of 3.4521 indicates that BAS 05896403 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 137.97 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 05896403. Following Lipinski's Rule of Five, BAS 05896403 has 3 hydrogen bond donor(s) and 7 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 05896403?
The CAS number of BAS 05896403 is 799252-40-7.
What is the molecular formula of BAS 05896403?
The molecular formula of BAS 05896403 is C20H17N5O3S2.
What is the molecular weight of BAS 05896403?
The molecular weight of BAS 05896403 is 439.08 g/mol.
Where can I buy BAS 05896403?
You can request a quote for BAS 05896403 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 05896403?
Yes, KEHONG BIO provides custom synthesis services for BAS 05896403 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.