1-(4-Nitrophenyl)-3-(1,3-thiazol-2-ylamino)propan-1-one
TL;DR: 1-(4-Nitrophenyl)-3-(1,3-thiazol-2-ylamino)propan-1-one (CAS 7269-89-8) is a chemical compound with molecular formula C12H11N3O3S and molecular weight 277.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(4-nitrophenyl)-3-(1,3-thiazol-2-ylamino)propan-1-one
Also Known As: 1-(4-nitro-phenyl)-3-thiazol-2-ylamino-propan-1-one, 1-(4-nitrophenyl)-3-(1,3-thiazol-2-ylamino)propan-1-one
| Molecular Formula | C12H11N3O3S |
|---|---|
| Molecular Weight | 277.05 g/mol |
| LogP | 2.7362 |
| Topological Polar Surface Area | 85.13 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 277.05212 |
| Heavy Atoms | 19 |
| Complexity | 566.41534 |
Chemical Identifiers
| CAS Number | 7269-89-8 |
|---|---|
| SMILES | C1=CC(=CC=C1C(=O)CCNC2=NC=CS2)[N+](=O)[O-] |
Product Overview
1-(4-Nitrophenyl)-3-(1,3-thiazol-2-ylamino)propan-1-one (CAS 7269-89-8), with molecular formula C12H11N3O3S and molecular weight 277.05 g/mol. IUPAC: 1-(4-nitrophenyl)-3-(1,3-thiazol-2-ylamino)propan-1-one.
Chemical Property Profile of 1-(4-Nitrophenyl)-3-(1,3-thiazol-2-ylamino)propan-1-one
Property Insights of 1-(4-Nitrophenyl)-3-(1,3-thiazol-2-ylamino)propan-1-one
The XLogP value of 2.7362 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(4-Nitrophenyl)-3-(1,3-thiazol-2-ylamino)propan-1-one. The TPSA of 85.13 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-(4-Nitrophenyl)-3-(1,3-thiazol-2-ylamino)propan-1-one. Following Lipinski's Rule of Five, 1-(4-Nitrophenyl)-3-(1,3-thiazol-2-ylamino)propan-1-one 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 1-(4-Nitrophenyl)-3-(1,3-thiazol-2-ylamino)propan-1-one?
The CAS number of 1-(4-Nitrophenyl)-3-(1,3-thiazol-2-ylamino)propan-1-one is 7269-89-8.
What is the molecular formula of 1-(4-Nitrophenyl)-3-(1,3-thiazol-2-ylamino)propan-1-one?
The molecular formula of 1-(4-Nitrophenyl)-3-(1,3-thiazol-2-ylamino)propan-1-one is C12H11N3O3S.
What is the molecular weight of 1-(4-Nitrophenyl)-3-(1,3-thiazol-2-ylamino)propan-1-one?
The molecular weight of 1-(4-Nitrophenyl)-3-(1,3-thiazol-2-ylamino)propan-1-one is 277.05 g/mol.
Where can I buy 1-(4-Nitrophenyl)-3-(1,3-thiazol-2-ylamino)propan-1-one?
You can request a quote for 1-(4-Nitrophenyl)-3-(1,3-thiazol-2-ylamino)propan-1-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(4-Nitrophenyl)-3-(1,3-thiazol-2-ylamino)propan-1-one?
Yes, KEHONG BIO provides custom synthesis services for 1-(4-Nitrophenyl)-3-(1,3-thiazol-2-ylamino)propan-1-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.