BAS 00435335
TL;DR: BAS 00435335 (CAS 488135-19-9) is a chemical compound with molecular formula C18H16FN5O3S3 and molecular weight 465.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[[4-[(5-ethyl-1,3,4-thiadiazol-2-yl)sulfamoyl]phenyl]carbamothioyl]-4-fluorobenzamide
Also Known As: BAS 00435335, N-((4-(N-(5-ethyl-1,3,4-thiadiazol-2-yl)sulfamoyl)phenyl)carbamothioyl)-4-fluorobenzamide, N-({4-[(5-ethyl-1,3,4-thiadiazol-2-yl)sulfamoyl]phenyl}carbamothioyl)-4-fluorobenzamide, N-(5-Ethyl-[1,3,4]thiadiazol-2-yl)-4-[3-(4-fluoro-benzoyl)-thioureido]-benzenesulfonamide, N-[[4-[(5-ethyl-1,3,4-thiadiazol-2-yl)sulfamoyl]phenyl]carbamothioyl]-4-fluorobenzamide
| Molecular Formula | C18H16FN5O3S3 |
|---|---|
| Molecular Weight | 465.04 g/mol |
| LogP | 3.1672 |
| Topological Polar Surface Area | 113.08 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 6 |
| Exact Mass | 465.03992 |
| Heavy Atoms | 30 |
| Complexity | 1162.5375 |
Chemical Identifiers
| CAS Number | 488135-19-9 |
|---|---|
| SMILES | CCC1=NN=C(S1)NS(=O)(=O)C2=CC=C(C=C2)NC(=S)NC(=O)C3=CC=C(C=C3)F |
Product Overview
BAS 00435335 (CAS 488135-19-9), with molecular formula C18H16FN5O3S3 and molecular weight 465.04 g/mol. IUPAC: N-[[4-[(5-ethyl-1,3,4-thiadiazol-2-yl)sulfamoyl]phenyl]carbamothioyl]-4-fluorobenzamide.
Chemical Property Profile of BAS 00435335
Property Insights of BAS 00435335
The XLogP value of 3.1672 indicates that BAS 00435335 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 BAS 00435335. Following Lipinski's Rule of Five, BAS 00435335 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 00435335?
The CAS number of BAS 00435335 is 488135-19-9.
What is the molecular formula of BAS 00435335?
The molecular formula of BAS 00435335 is C18H16FN5O3S3.
What is the molecular weight of BAS 00435335?
The molecular weight of BAS 00435335 is 465.04 g/mol.
Where can I buy BAS 00435335?
You can request a quote for BAS 00435335 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 00435335?
Yes, KEHONG BIO provides custom synthesis services for BAS 00435335 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.