F1831-0093
TL;DR: F1831-0093 (CAS 893096-36-1) is a chemical compound with molecular formula C22H28N2O2S and molecular weight 384.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(4-tert-butylbenzoyl)amino]-N-methyl-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carboxamide
Also Known As: F1831-0093, 2-(4-tert-butylbenzamido)-N-methyl-4H,5H,6H,7H,8H-cyclohepta[b]thiophene-3-carboxamide, 2-(4-(tert-butyl)benzamido)-N-methyl-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carboxamide, 2-[(4-tert-butylbenzoyl)amino]-N-methyl-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carboxamide
| Molecular Formula | C22H28N2O2S |
|---|---|
| Molecular Weight | 384.19 g/mol |
| LogP | 4.9264 |
| Topological Polar Surface Area | 58.2 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 384.18716 |
| Heavy Atoms | 27 |
| Complexity | 844.4331 |
Chemical Identifiers
| CAS Number | 893096-36-1 |
|---|---|
| SMILES | CC(C)(C)C1=CC=C(C=C1)C(=O)NC2=C(C3=C(S2)CCCCC3)C(=O)NC |
Product Overview
F1831-0093 (CAS 893096-36-1), with molecular formula C22H28N2O2S and molecular weight 384.19 g/mol. IUPAC: 2-[(4-tert-butylbenzoyl)amino]-N-methyl-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carboxamide.
Chemical Property Profile of F1831-0093
Property Insights of F1831-0093
The XLogP value of 4.9264 indicates that F1831-0093 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 58.2 Ų, F1831-0093 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, F1831-0093 has 2 hydrogen bond donor(s) and 3 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 F1831-0093?
The CAS number of F1831-0093 is 893096-36-1.
What is the molecular formula of F1831-0093?
The molecular formula of F1831-0093 is C22H28N2O2S.
What is the molecular weight of F1831-0093?
The molecular weight of F1831-0093 is 384.19 g/mol.
Where can I buy F1831-0093?
You can request a quote for F1831-0093 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F1831-0093?
Yes, KEHONG BIO provides custom synthesis services for F1831-0093 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.