AB00157623-05
TL;DR: AB00157623-05 (CAS 958708-80-0) is a chemical compound with molecular formula C16H18BrN3O2S and molecular weight 395.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-bromo-N-(2-tert-butyl-5-oxo-4,6-dihydrothieno[3,4-c]pyrazol-3-yl)benzamide
Also Known As: AB00157623-05, F0561-0397, 4-bromo-N-(2-(tert-butyl)-5-oxido-4,6-dihydro-2H-thieno[3,4-c]pyrazol-3-yl)benzamide, 4-bromo-N-(2-tert-butyl-5-oxo-4,6-dihydrothieno[3,4-c]pyrazol-3-yl)benzamide, 4-bromo-N-{2-tert-butyl-5-oxo-2H,4H,6H-5lambda4-thieno[3,4-c]pyrazol-3-yl}benzamide
| Molecular Formula | C16H18BrN3O2S |
|---|---|
| Molecular Weight | 395.03 g/mol |
| LogP | 3.4152 |
| Topological Polar Surface Area | 63.99 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 395.0303 |
| Heavy Atoms | 23 |
| Complexity | 790.8921 |
Chemical Identifiers
| CAS Number | 958708-80-0 |
|---|---|
| SMILES | CC(C)(C)N1C(=C2CS(=O)CC2=N1)NC(=O)C3=CC=C(C=C3)Br |
Product Overview
AB00157623-05 (CAS 958708-80-0), with molecular formula C16H18BrN3O2S and molecular weight 395.03 g/mol. IUPAC: 4-bromo-N-(2-tert-butyl-5-oxo-4,6-dihydrothieno[3,4-c]pyrazol-3-yl)benzamide.
Chemical Property Profile of AB00157623-05
Property Insights of AB00157623-05
The XLogP value of 3.4152 indicates that AB00157623-05 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 63.99 Ų falls within the moderate polarity range, balancing permeability and solubility for AB00157623-05. Following Lipinski's Rule of Five, AB00157623-05 has 1 hydrogen bond donor(s) and 3 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 AB00157623-05?
The CAS number of AB00157623-05 is 958708-80-0.
What is the molecular formula of AB00157623-05?
The molecular formula of AB00157623-05 is C16H18BrN3O2S.
What is the molecular weight of AB00157623-05?
The molecular weight of AB00157623-05 is 395.03 g/mol.
Where can I buy AB00157623-05?
You can request a quote for AB00157623-05 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AB00157623-05?
Yes, KEHONG BIO provides custom synthesis services for AB00157623-05 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.