BAS 01128372
TL;DR: BAS 01128372 (CAS 332115-35-2) is a chemical compound with molecular formula C18H17N3O5S and molecular weight 387.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[(E)-3-morpholin-4-yl-1-(3-nitrophenyl)-3-oxoprop-1-en-2-yl]thiophene-2-carboxamide
Also Known As: BAS 01128372, (E)-N-(3-morpholino-1-(3-nitrophenyl)-3-oxoprop-1-en-2-yl)thiophene-2-carboxamide, N-[(E)-3-morpholin-4-yl-1-(3-nitrophenyl)-3-oxoprop-1-en-2-yl]thiophene-2-carboxamide, N-{2-morpholin-4-yl-1-[(3-nitrophenyl)methylene]-2-oxoethyl}-2-thienylcarboxam ide
| Molecular Formula | C18H17N3O5S |
|---|---|
| Molecular Weight | 387.09 g/mol |
| LogP | 2.286 |
| Topological Polar Surface Area | 101.78 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 387.0889 |
| Heavy Atoms | 27 |
| Complexity | 872.8821 |
Chemical Identifiers
| CAS Number | 332115-35-2 |
|---|---|
| SMILES | C1COCCN1C(=O)/C(=C\C2=CC(=CC=C2)[N+](=O)[O-])/NC(=O)C3=CC=CS3 |
Product Overview
BAS 01128372 (CAS 332115-35-2), with molecular formula C18H17N3O5S and molecular weight 387.09 g/mol. IUPAC: N-[(E)-3-morpholin-4-yl-1-(3-nitrophenyl)-3-oxoprop-1-en-2-yl]thiophene-2-carboxamide.
Chemical Property Profile of BAS 01128372
Property Insights of BAS 01128372
The XLogP value of 2.286 suggests moderate lipophilicity, balancing water solubility and membrane permeability for BAS 01128372. The TPSA of 101.78 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 01128372. Following Lipinski's Rule of Five, BAS 01128372 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 01128372?
The CAS number of BAS 01128372 is 332115-35-2.
What is the molecular formula of BAS 01128372?
The molecular formula of BAS 01128372 is C18H17N3O5S.
What is the molecular weight of BAS 01128372?
The molecular weight of BAS 01128372 is 387.09 g/mol.
Where can I buy BAS 01128372?
You can request a quote for BAS 01128372 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 01128372?
Yes, KEHONG BIO provides custom synthesis services for BAS 01128372 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.