BIM-0042318.P001
TL;DR: BIM-0042318.P001 (CAS 6046-45-3) is a chemical compound with molecular formula C24H25N3OS2 and molecular weight 435.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(2-methylphenyl)-2-(phenylcarbamothioylamino)-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carboxamide
Also Known As: BIM-0042318.P001, N-(2-methylphenyl)-2-(phenylcarbamothioylamino)-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carboxamide, 2-[(anilinocarbonothioyl)amino]-N-(2-methylphenyl)-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carboxamide, N-(2-methylphenyl)(2-{[(phenylamino)thioxomethyl]amino}(4,5,6,7,8-pentahydrocy clohepta[1,2-b]thiophen-3-yl))carboxamide, N-(2-methylphenyl)-2-[(phenylcarbamothioyl)amino]-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carboxamide
| Molecular Formula | C24H25N3OS2 |
|---|---|
| Molecular Weight | 435.14 g/mol |
| LogP | 6.38662 |
| Topological Polar Surface Area | 53.16 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 435.1439 |
| Heavy Atoms | 30 |
| Complexity | 1059.5679 |
Chemical Identifiers
| CAS Number | 6046-45-3 |
|---|---|
| SMILES | CC1=CC=CC=C1NC(=O)C2=C(SC3=C2CCCCC3)NC(=S)NC4=CC=CC=C4 |
Product Overview
BIM-0042318.P001 (CAS 6046-45-3), with molecular formula C24H25N3OS2 and molecular weight 435.14 g/mol. IUPAC: N-(2-methylphenyl)-2-(phenylcarbamothioylamino)-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carboxamide.
Chemical Property Profile of BIM-0042318.P001
Property Insights of BIM-0042318.P001
The XLogP value of 6.38662 indicates that BIM-0042318.P001 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 53.16 Ų, BIM-0042318.P001 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, BIM-0042318.P001 has 3 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of BIM-0042318.P001?
The CAS number of BIM-0042318.P001 is 6046-45-3.
What is the molecular formula of BIM-0042318.P001?
The molecular formula of BIM-0042318.P001 is C24H25N3OS2.
What is the molecular weight of BIM-0042318.P001?
The molecular weight of BIM-0042318.P001 is 435.14 g/mol.
Where can I buy BIM-0042318.P001?
You can request a quote for BIM-0042318.P001 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BIM-0042318.P001?
Yes, KEHONG BIO provides custom synthesis services for BIM-0042318.P001 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.