BAS 01248095
TL;DR: BAS 01248095 (CAS 332154-91-3) is a chemical compound with molecular formula C17H13BrN4O5S and molecular weight 463.98 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[[5-(2-bromophenyl)-1,3,4-oxadiazol-2-yl]sulfanyl]-N-(3-methoxy-4-nitrophenyl)acetamide
Also Known As: BAS 01248095, 2-((5-(2-Bromophenyl)-1,3,4-oxadiazol-2-yl)thio)-N-(3-methoxy-4-nitrophenyl)acetamide, 2-[[5-(2-bromophenyl)-1,3,4-oxadiazol-2-yl]sulfanyl]-N-(3-methoxy-4-nitrophenyl)acetamide, 2-[5-(2-bromophenyl)(1,3,4-oxadiazol-2-ylthio)]-N-(3-methoxy-4-nitrophenyl)ace tamide, 2-{[5-(2-bromophenyl)-1,3,4-oxadiazol-2-yl]sulfanyl}-N-{4-nitro-3-methoxyphenyl}acetamide
| Molecular Formula | C17H13BrN4O5S |
|---|---|
| Molecular Weight | 463.98 g/mol |
| LogP | 4.1467 |
| Topological Polar Surface Area | 120.39 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 7 |
| Exact Mass | 463.979 |
| Heavy Atoms | 28 |
| Complexity | 1026.2872 |
Chemical Identifiers
| CAS Number | 332154-91-3 |
|---|---|
| SMILES | COC1=C(C=CC(=C1)NC(=O)CSC2=NN=C(O2)C3=CC=CC=C3Br)[N+](=O)[O-] |
Product Overview
BAS 01248095 (CAS 332154-91-3), with molecular formula C17H13BrN4O5S and molecular weight 463.98 g/mol. IUPAC: 2-[[5-(2-bromophenyl)-1,3,4-oxadiazol-2-yl]sulfanyl]-N-(3-methoxy-4-nitrophenyl)acetamide.
Chemical Property Profile of BAS 01248095
Property Insights of BAS 01248095
The XLogP value of 4.1467 indicates that BAS 01248095 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 120.39 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 01248095. Following Lipinski's Rule of Five, BAS 01248095 has 1 hydrogen bond donor(s) and 8 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 01248095?
The CAS number of BAS 01248095 is 332154-91-3.
What is the molecular formula of BAS 01248095?
The molecular formula of BAS 01248095 is C17H13BrN4O5S.
What is the molecular weight of BAS 01248095?
The molecular weight of BAS 01248095 is 463.98 g/mol.
Where can I buy BAS 01248095?
You can request a quote for BAS 01248095 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 01248095?
Yes, KEHONG BIO provides custom synthesis services for BAS 01248095 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.