F5127-0267
TL;DR: F5127-0267 (CAS 512807-25-9) is a chemical compound with molecular formula C16H19N3O3S and molecular weight 333.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 2-[(1-ethylpyrazole-3-carbonyl)amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Also Known As: F5127-0267, methyl 2-{[(1-ethyl-1H-pyrazol-3-yl)carbonyl]amino}-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate, methyl 2-(1-ethyl-1H-pyrazole-3-carboxamido)-4,5,6,7-tetrahydrobenzo[b]thiophene-3-carboxylate, methyl 2-[(1-ethylpyrazole-3-carbonyl)amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate, Methyl 2-[(1-ethylpyrazole-3-carbonyl)amino]-4,5,6,7-tetrahydrobenzothiophene-3-carboxylate
| Molecular Formula | C16H19N3O3S |
|---|---|
| Molecular Weight | 333.11 g/mol |
| LogP | 2.8822 |
| Topological Polar Surface Area | 73.22 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 333.11472 |
| Heavy Atoms | 23 |
| Complexity | 747.8346 |
Chemical Identifiers
| CAS Number | 512807-25-9 |
|---|---|
| SMILES | CCN1C=CC(=N1)C(=O)NC2=C(C3=C(S2)CCCC3)C(=O)OC |
Product Overview
F5127-0267 (CAS 512807-25-9), with molecular formula C16H19N3O3S and molecular weight 333.11 g/mol. IUPAC: methyl 2-[(1-ethylpyrazole-3-carbonyl)amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate.
Chemical Property Profile of F5127-0267
Property Insights of F5127-0267
The XLogP value of 2.8822 suggests moderate lipophilicity, balancing water solubility and membrane permeability for F5127-0267. The TPSA of 73.22 Ų falls within the moderate polarity range, balancing permeability and solubility for F5127-0267. Following Lipinski's Rule of Five, F5127-0267 has 1 hydrogen bond donor(s) and 5 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 F5127-0267?
The CAS number of F5127-0267 is 512807-25-9.
What is the molecular formula of F5127-0267?
The molecular formula of F5127-0267 is C16H19N3O3S.
What is the molecular weight of F5127-0267?
The molecular weight of F5127-0267 is 333.11 g/mol.
Where can I buy F5127-0267?
You can request a quote for F5127-0267 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F5127-0267?
Yes, KEHONG BIO provides custom synthesis services for F5127-0267 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.