BAS 10850747
TL;DR: BAS 10850747 (CAS 876878-72-7) is a chemical compound with molecular formula C15H17N3O3S and molecular weight 319.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[[5-(4-hydroxyphenyl)-1,3,4-oxadiazol-2-yl]sulfanyl]-1-pyrrolidin-1-ylpropan-1-one
Also Known As: BAS 10850747, 3-((5-(4-hydroxyphenyl)-1,3,4-oxadiazol-2-yl)thio)-1-(pyrrolidin-1-yl)propan-1-one, 3-{[5-(4-hydroxyphenyl)-1,3,4-oxadiazol-2-yl]sulfanyl}-1-(pyrrolidin-1-yl)propan-1-one, 4-[5-(3-oxo-3-pyrrolidin-1-ylpropyl)sulfanyl-3H-1,3,4-oxadiazol-2-ylidene]cyclohexa-2,5-dien-1-one
| Molecular Formula | C15H17N3O3S |
|---|---|
| Molecular Weight | 319.10 g/mol |
| LogP | 2.5468 |
| Topological Polar Surface Area | 79.46 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 319.09906 |
| Heavy Atoms | 22 |
| Complexity | 635.7372 |
Chemical Identifiers
| CAS Number | 876878-72-7 |
|---|---|
| SMILES | C1CCN(C1)C(=O)CCSC2=NN=C(O2)C3=CC=C(C=C3)O |
Product Overview
BAS 10850747 (CAS 876878-72-7), with molecular formula C15H17N3O3S and molecular weight 319.10 g/mol. IUPAC: 3-[[5-(4-hydroxyphenyl)-1,3,4-oxadiazol-2-yl]sulfanyl]-1-pyrrolidin-1-ylpropan-1-one.
Chemical Property Profile of BAS 10850747
Property Insights of BAS 10850747
The XLogP value of 2.5468 suggests moderate lipophilicity, balancing water solubility and membrane permeability for BAS 10850747. The TPSA of 79.46 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 10850747. Following Lipinski's Rule of Five, BAS 10850747 has 1 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 BAS 10850747?
The CAS number of BAS 10850747 is 876878-72-7.
What is the molecular formula of BAS 10850747?
The molecular formula of BAS 10850747 is C15H17N3O3S.
What is the molecular weight of BAS 10850747?
The molecular weight of BAS 10850747 is 319.10 g/mol.
Where can I buy BAS 10850747?
You can request a quote for BAS 10850747 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 10850747?
Yes, KEHONG BIO provides custom synthesis services for BAS 10850747 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.