ChemDiv2_001035
TL;DR: ChemDiv2_001035 (CAS 352555-46-5) is a chemical compound with molecular formula C19H25N3O2S and molecular weight 359.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-cyclohexyl-5-methyl-2-oxo-4-thia-1,8-diazatricyclo[7.5.0.03,7]tetradeca-3(7),5,8-triene-6-carboxamide
Also Known As: ChemDiv2_001035, BIM-0042038.P001, N-cyclohexyl-2-methyl-11-oxo-5,6,7,8,9,11-hexahydrothieno[3',2':4,5]pyrimido[1,2-a]azepine-3-carboxamide, 2-Methyl-10-oxo-5,6,7,8,9,10-hexahydro-1-thia-4,9a-diaza-cyclohepta[f]indene-3-carboxylic acid cyclohexylamide, N-cyclohexyl-2-methyl-11-oxo-6,7,8,9-tetrahydro-5H-thieno[1,2]pyrimido[4,5-a]azepine-3-carboxamide
| Molecular Formula | C19H25N3O2S |
|---|---|
| Molecular Weight | 359.17 g/mol |
| LogP | 3.55532 |
| Topological Polar Surface Area | 63.99 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 359.16675 |
| Heavy Atoms | 25 |
| Complexity | 861.65686 |
Chemical Identifiers
| CAS Number | 352555-46-5 |
|---|---|
| SMILES | CC1=C(C2=C(S1)C(=O)N3CCCCCC3=N2)C(=O)NC4CCCCC4 |
Product Overview
ChemDiv2_001035 (CAS 352555-46-5), with molecular formula C19H25N3O2S and molecular weight 359.17 g/mol. IUPAC: N-cyclohexyl-5-methyl-2-oxo-4-thia-1,8-diazatricyclo[7.5.0.03,7]tetradeca-3(7),5,8-triene-6-carboxamide.
Chemical Property Profile of ChemDiv2_001035
Property Insights of ChemDiv2_001035
The XLogP value of 3.55532 indicates that ChemDiv2_001035 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 63.99 Ų falls within the moderate polarity range, balancing permeability and solubility for ChemDiv2_001035. Following Lipinski's Rule of Five, ChemDiv2_001035 has 1 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 ChemDiv2_001035?
The CAS number of ChemDiv2_001035 is 352555-46-5.
What is the molecular formula of ChemDiv2_001035?
The molecular formula of ChemDiv2_001035 is C19H25N3O2S.
What is the molecular weight of ChemDiv2_001035?
The molecular weight of ChemDiv2_001035 is 359.17 g/mol.
Where can I buy ChemDiv2_001035?
You can request a quote for ChemDiv2_001035 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ChemDiv2_001035?
Yes, KEHONG BIO provides custom synthesis services for ChemDiv2_001035 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.