BAS 01516653
TL;DR: BAS 01516653 (CAS 332377-38-5) is a chemical compound with molecular formula C21H16N4O5S and molecular weight 436.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[[5-(3-hydroxynaphthalen-2-yl)-1,3,4-oxadiazol-2-yl]sulfanyl]-N-(4-methyl-3-nitrophenyl)acetamide
Also Known As: BAS 01516653, 2-((5-(3-Hydroxynaphthalen-2-yl)-1,3,4-oxadiazol-2-yl)thio)-N-(4-methyl-3-nitrophenyl)acetamide, 2-{[5-(3-HYDROXYNAPHTHALEN-2-YL)-1,3,4-OXADIAZOL-2-YL]SULFANYL}-N-(4-METHYL-3-NITROPHENYL)ACETAMIDE, 2-[5-(3-Hydroxy-naphthalen-2-yl)-[1,3,4]oxadiazol-2-ylsulfanyl]-N-(4-methyl-3-nitro-phenyl)-acetamide, 2-{[5-(3-hydroxynaphthalen-2-yl)-1,3,4-oxadiazol-2-yl]sulfanyl}-N-{3-nitro-4-methylphenyl}acetamide
| Molecular Formula | C21H16N4O5S |
|---|---|
| Molecular Weight | 436.08 g/mol |
| LogP | 4.54282 |
| Topological Polar Surface Area | 131.39 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 6 |
| Exact Mass | 436.08414 |
| Heavy Atoms | 31 |
| Complexity | 1304.1747 |
Chemical Identifiers
| CAS Number | 332377-38-5 |
|---|---|
| SMILES | CC1=C(C=C(C=C1)NC(=O)CSC2=NN=C(O2)C3=CC4=CC=CC=C4C=C3O)[N+](=O)[O-] |
Product Overview
BAS 01516653 (CAS 332377-38-5), with molecular formula C21H16N4O5S and molecular weight 436.08 g/mol. IUPAC: 2-[[5-(3-hydroxynaphthalen-2-yl)-1,3,4-oxadiazol-2-yl]sulfanyl]-N-(4-methyl-3-nitrophenyl)acetamide.
Chemical Property Profile of BAS 01516653
Property Insights of BAS 01516653
The XLogP value of 4.54282 indicates that BAS 01516653 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 131.39 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 01516653. Following Lipinski's Rule of Five, BAS 01516653 has 2 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 01516653?
The CAS number of BAS 01516653 is 332377-38-5.
What is the molecular formula of BAS 01516653?
The molecular formula of BAS 01516653 is C21H16N4O5S.
What is the molecular weight of BAS 01516653?
The molecular weight of BAS 01516653 is 436.08 g/mol.
Where can I buy BAS 01516653?
You can request a quote for BAS 01516653 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 01516653?
Yes, KEHONG BIO provides custom synthesis services for BAS 01516653 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.