F1831-0072
TL;DR: F1831-0072 (CAS 868965-81-5) is a chemical compound with molecular formula C16H16Cl2N2O2S2 and molecular weight 402.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(2,5-dichlorothiophene-3-carbonyl)amino]-N-methyl-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carboxamide
Also Known As: F1831-0072, 2,5-dichloro-N-[3-(methylcarbamoyl)-4H,5H,6H,7H,8H-cyclohepta[b]thiophen-2-yl]thiophene-3-carboxamide, 2-(2,5-dichlorothiophene-3-carboxamido)-N-methyl-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carboxamide, 2-[(2,5-dichlorothiophene-3-carbonyl)amino]-N-methyl-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carboxamide
| Molecular Formula | C16H16Cl2N2O2S2 |
|---|---|
| Molecular Weight | 402.00 g/mol |
| LogP | 4.9972 |
| Topological Polar Surface Area | 58.2 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 402.00302 |
| Heavy Atoms | 24 |
| Complexity | 798.3429 |
Chemical Identifiers
| CAS Number | 868965-81-5 |
|---|---|
| SMILES | CNC(=O)C1=C(SC2=C1CCCCC2)NC(=O)C3=C(SC(=C3)Cl)Cl |
Product Overview
F1831-0072 (CAS 868965-81-5), with molecular formula C16H16Cl2N2O2S2 and molecular weight 402.00 g/mol. IUPAC: 2-[(2,5-dichlorothiophene-3-carbonyl)amino]-N-methyl-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carboxamide.
Chemical Property Profile of F1831-0072
Property Insights of F1831-0072
The XLogP value of 4.9972 indicates that F1831-0072 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 58.2 Ų, F1831-0072 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, F1831-0072 has 2 hydrogen bond donor(s) and 4 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 F1831-0072?
The CAS number of F1831-0072 is 868965-81-5.
What is the molecular formula of F1831-0072?
The molecular formula of F1831-0072 is C16H16Cl2N2O2S2.
What is the molecular weight of F1831-0072?
The molecular weight of F1831-0072 is 402.00 g/mol.
Where can I buy F1831-0072?
You can request a quote for F1831-0072 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F1831-0072?
Yes, KEHONG BIO provides custom synthesis services for F1831-0072 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.