chemical diversity library compound 8
TL;DR: chemical diversity library compound 8 (CAS 314765-32-7) is a chemical compound with molecular formula C17H16ClN5O3S2 and molecular weight 437.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(4-chlorophenyl)-3-[4-[(5-ethyl-1,3,4-thiadiazol-2-yl)sulfamoyl]phenyl]urea
Also Known As: chemical diversity library compound 8, BAS 01046910, AN-329/40252290, 1-(4-chlorophenyl)-3-[4-[(5-ethyl-1,3,4-thiadiazol-2-yl)sulfamoyl]phenyl]urea, 4-{[(4-chloroanilino)carbonyl]amino}-N-(5-ethyl-1,3,4-thiadiazol-2-yl)benzenesulfonamide
| Molecular Formula | C17H16ClN5O3S2 |
|---|---|
| Molecular Weight | 437.04 g/mol |
| LogP | 4.1987 |
| Topological Polar Surface Area | 113.08 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 437.0383 |
| Heavy Atoms | 28 |
| Complexity | 1066.9321 |
Chemical Identifiers
| CAS Number | 314765-32-7 |
|---|---|
| SMILES | CCC1=NN=C(S1)NS(=O)(=O)C2=CC=C(C=C2)NC(=O)NC3=CC=C(C=C3)Cl |
Product Overview
chemical diversity library compound 8 (CAS 314765-32-7), with molecular formula C17H16ClN5O3S2 and molecular weight 437.04 g/mol. IUPAC: 1-(4-chlorophenyl)-3-[4-[(5-ethyl-1,3,4-thiadiazol-2-yl)sulfamoyl]phenyl]urea.
Chemical Property Profile of chemical diversity library compound 8
Property Insights of chemical diversity library compound 8
The XLogP value of 4.1987 indicates that chemical diversity library compound 8 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 113.08 Ų falls within the moderate polarity range, balancing permeability and solubility for chemical diversity library compound 8. Following Lipinski's Rule of Five, chemical diversity library compound 8 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 chemical diversity library compound 8?
The CAS number of chemical diversity library compound 8 is 314765-32-7.
What is the molecular formula of chemical diversity library compound 8?
The molecular formula of chemical diversity library compound 8 is C17H16ClN5O3S2.
What is the molecular weight of chemical diversity library compound 8?
The molecular weight of chemical diversity library compound 8 is 437.04 g/mol.
Where can I buy chemical diversity library compound 8?
You can request a quote for chemical diversity library compound 8 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for chemical diversity library compound 8?
Yes, KEHONG BIO provides custom synthesis services for chemical diversity library compound 8 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.