![N-[3-(2-hydroxyethylsulfanyl)-5-nitrophenyl]-3-(tetrazol-1-yl)propanamide structure](/static/products/6770/677014-80-1.webp)
N-[3-(2-hydroxyethylsulfanyl)-5-nitrophenyl]-3-(tetrazol-1-yl)propanamide
TL;DR: N-[3-(2-hydroxyethylsulfanyl)-5-nitrophenyl]-3-(tetrazol-1-yl)propanamide (CAS 677014-80-1) is a chemical compound with molecular formula C12H14N6O4S and molecular weight 338.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[3-(2-hydroxyethylsulfanyl)-5-nitrophenyl]-3-(tetrazol-1-yl)propanamide
Also Known As: N-[3-(2-hydroxyethylsulfanyl)-5-nitrophenyl]-3-(tetrazol-1-yl)propanamide, N-[3-(2-hydroxyethylsulfanyl)-5-nitro-phenyl]-3-(tetrazol-1-yl)propanamide, N-{3-[(2-hydroxyethyl)sulfanyl]-5-nitrophenyl}-3-(1H-tetrazol-1-yl)propanamide, N-{3-[(2-HYDROXYETHYL)SULFANYL]-5-NITROPHENYL}-3-(1H-1,2,3,4-TETRAAZOL-1-YL)PROPANAMIDE
| Molecular Formula | C12H14N6O4S |
|---|---|
| Molecular Weight | 338.08 g/mol |
| LogP | 0.6945 |
| Topological Polar Surface Area | 136.07 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 8 |
| Exact Mass | 338.0797 |
| Heavy Atoms | 23 |
| Complexity | 678.1954 |
Chemical Identifiers
| CAS Number | 677014-80-1 |
|---|---|
| SMILES | C1=C(C=C(C=C1[N+](=O)[O-])SCCO)NC(=O)CCN2C=NN=N2 |
Product Overview
N-[3-(2-hydroxyethylsulfanyl)-5-nitrophenyl]-3-(tetrazol-1-yl)propanamide (CAS 677014-80-1), with molecular formula C12H14N6O4S and molecular weight 338.08 g/mol. IUPAC: N-[3-(2-hydroxyethylsulfanyl)-5-nitrophenyl]-3-(tetrazol-1-yl)propanamide.
Chemical Property Profile of N-[3-(2-hydroxyethylsulfanyl)-5-nitrophenyl]-3-(tetrazol-1-yl)propanamide
Property Insights of N-[3-(2-hydroxyethylsulfanyl)-5-nitrophenyl]-3-(tetrazol-1-yl)propanamide
The XLogP value of 0.6945 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-[3-(2-hydroxyethylsulfanyl)-5-nitrophenyl]-3-(tetrazol-1-yl)propanamide. The TPSA of 136.07 Ų falls within the moderate polarity range, balancing permeability and solubility for N-[3-(2-hydroxyethylsulfanyl)-5-nitrophenyl]-3-(tetrazol-1-yl)propanamide. Following Lipinski's Rule of Five, N-[3-(2-hydroxyethylsulfanyl)-5-nitrophenyl]-3-(tetrazol-1-yl)propanamide 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 N-[3-(2-hydroxyethylsulfanyl)-5-nitrophenyl]-3-(tetrazol-1-yl)propanamide?
The CAS number of N-[3-(2-hydroxyethylsulfanyl)-5-nitrophenyl]-3-(tetrazol-1-yl)propanamide is 677014-80-1.
What is the molecular formula of N-[3-(2-hydroxyethylsulfanyl)-5-nitrophenyl]-3-(tetrazol-1-yl)propanamide?
The molecular formula of N-[3-(2-hydroxyethylsulfanyl)-5-nitrophenyl]-3-(tetrazol-1-yl)propanamide is C12H14N6O4S.
What is the molecular weight of N-[3-(2-hydroxyethylsulfanyl)-5-nitrophenyl]-3-(tetrazol-1-yl)propanamide?
The molecular weight of N-[3-(2-hydroxyethylsulfanyl)-5-nitrophenyl]-3-(tetrazol-1-yl)propanamide is 338.08 g/mol.
Where can I buy N-[3-(2-hydroxyethylsulfanyl)-5-nitrophenyl]-3-(tetrazol-1-yl)propanamide?
You can request a quote for N-[3-(2-hydroxyethylsulfanyl)-5-nitrophenyl]-3-(tetrazol-1-yl)propanamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-[3-(2-hydroxyethylsulfanyl)-5-nitrophenyl]-3-(tetrazol-1-yl)propanamide?
Yes, KEHONG BIO provides custom synthesis services for N-[3-(2-hydroxyethylsulfanyl)-5-nitrophenyl]-3-(tetrazol-1-yl)propanamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.