CBChromo1_000121
TL;DR: CBChromo1_000121 (CAS 331445-75-1) is a chemical compound with molecular formula C17H14N4O4S3 and molecular weight 434.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(E)-3-(furan-2-yl)-N-[[4-(1,3-thiazol-2-ylsulfamoyl)phenyl]carbamothioyl]prop-2-enamide
Also Known As: CBChromo1_000121, BAS 00413545, (E)-3-(furan-2-yl)-N-[[4-(1,3-thiazol-2-ylsulfamoyl)phenyl]carbamothioyl]prop-2-enamide, (2E)-3-(furan-2-yl)-N-{[4-(1,3-thiazol-2-ylsulfamoyl)phenyl]carbamothioyl}prop-2-enamide, (E)-3-(furan-2-yl)-N-((4-(N-(thiazol-2-yl)sulfamoyl)phenyl)carbamothioyl)acrylamide
| Molecular Formula | C17H14N4O4S3 |
|---|---|
| Molecular Weight | 434.02 g/mol |
| LogP | 3.0633 |
| Topological Polar Surface Area | 113.33 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 6 |
| Exact Mass | 434.01773 |
| Heavy Atoms | 28 |
| Complexity | 1074.1481 |
Chemical Identifiers
| CAS Number | 331445-75-1 |
|---|---|
| SMILES | C1=COC(=C1)/C=C/C(=O)NC(=S)NC2=CC=C(C=C2)S(=O)(=O)NC3=NC=CS3 |
Product Overview
CBChromo1_000121 (CAS 331445-75-1), with molecular formula C17H14N4O4S3 and molecular weight 434.02 g/mol. IUPAC: (E)-3-(furan-2-yl)-N-[[4-(1,3-thiazol-2-ylsulfamoyl)phenyl]carbamothioyl]prop-2-enamide.
Chemical Property Profile of CBChromo1_000121
Property Insights of CBChromo1_000121
The XLogP value of 3.0633 indicates that CBChromo1_000121 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 113.33 Ų falls within the moderate polarity range, balancing permeability and solubility for CBChromo1_000121. Following Lipinski's Rule of Five, CBChromo1_000121 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 CBChromo1_000121?
The CAS number of CBChromo1_000121 is 331445-75-1.
What is the molecular formula of CBChromo1_000121?
The molecular formula of CBChromo1_000121 is C17H14N4O4S3.
What is the molecular weight of CBChromo1_000121?
The molecular weight of CBChromo1_000121 is 434.02 g/mol.
Where can I buy CBChromo1_000121?
You can request a quote for CBChromo1_000121 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for CBChromo1_000121?
Yes, KEHONG BIO provides custom synthesis services for CBChromo1_000121 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.