BAS 00756884
TL;DR: BAS 00756884 (CAS 348165-01-5) is a chemical compound with molecular formula C18H19N5O3S2 and molecular weight 417.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(E)-N-[[4-(diaminomethylideneamino)sulfonylphenyl]carbamothioyl]-3-(4-methylphenyl)prop-2-enamide
Also Known As: BAS 00756884, BIM-0008283.P001, (2E)-N-{[4-(carbamimidoylsulfamoyl)phenyl]carbamothioyl}-3-(4-methylphenyl)prop-2-enamide, (E)-N-((4-(N-carbamimidoylsulfamoyl)phenyl)carbamothioyl)-3-(p-tolyl)acrylamide, (2E)-N-[({4-[(amidinoamino)sulfonyl]phenyl}amino)thioxomethyl]-3-(4-methylphen yl)prop-2-enamide
| Molecular Formula | C18H19N5O3S2 |
|---|---|
| Molecular Weight | 417.09 g/mol |
| LogP | 1.48352 |
| Topological Polar Surface Area | 139.67 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 417.09293 |
| Heavy Atoms | 28 |
| Complexity | 1023.8957 |
Chemical Identifiers
| CAS Number | 348165-01-5 |
|---|---|
| SMILES | CC1=CC=C(C=C1)/C=C/C(=O)NC(=S)NC2=CC=C(C=C2)S(=O)(=O)N=C(N)N |
Product Overview
BAS 00756884 (CAS 348165-01-5), with molecular formula C18H19N5O3S2 and molecular weight 417.09 g/mol. IUPAC: (E)-N-[[4-(diaminomethylideneamino)sulfonylphenyl]carbamothioyl]-3-(4-methylphenyl)prop-2-enamide.
Chemical Property Profile of BAS 00756884
Property Insights of BAS 00756884
The XLogP value of 1.48352 suggests moderate lipophilicity, balancing water solubility and membrane permeability for BAS 00756884. The TPSA of 139.67 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 00756884. Following Lipinski's Rule of Five, BAS 00756884 has 4 hydrogen bond donor(s) and 4 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 00756884?
The CAS number of BAS 00756884 is 348165-01-5.
What is the molecular formula of BAS 00756884?
The molecular formula of BAS 00756884 is C18H19N5O3S2.
What is the molecular weight of BAS 00756884?
The molecular weight of BAS 00756884 is 417.09 g/mol.
Where can I buy BAS 00756884?
You can request a quote for BAS 00756884 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 00756884?
Yes, KEHONG BIO provides custom synthesis services for BAS 00756884 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.