ChemDiv1_008554
TL;DR: ChemDiv1_008554 (CAS 315702-37-5) is a chemical compound with molecular formula C19H25N3O2S2 and molecular weight 391.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-cyclohexyl-2-[(3-methyl-4-oxo-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-2-yl)sulfanyl]acetamide
Also Known As: ChemDiv1_008554, BAS 03352740, N-cyclohexyl-2-[(3-methyl-4-oxo-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-2-yl)sulfanyl]acetamide, AF-399/15599326, F0878-0009
| Molecular Formula | C19H25N3O2S2 |
|---|---|
| Molecular Weight | 391.14 g/mol |
| LogP | 3.4148 |
| Topological Polar Surface Area | 63.99 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 391.13882 |
| Heavy Atoms | 26 |
| Complexity | 881.0171 |
Chemical Identifiers
| CAS Number | 315702-37-5 |
|---|---|
| SMILES | CN1C(=O)C2=C(N=C1SCC(=O)NC3CCCCC3)SC4=C2CCCC4 |
Product Overview
ChemDiv1_008554 (CAS 315702-37-5), with molecular formula C19H25N3O2S2 and molecular weight 391.14 g/mol. IUPAC: N-cyclohexyl-2-[(3-methyl-4-oxo-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-2-yl)sulfanyl]acetamide.
Chemical Property Profile of ChemDiv1_008554
Property Insights of ChemDiv1_008554
The XLogP value of 3.4148 indicates that ChemDiv1_008554 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 ChemDiv1_008554. Following Lipinski's Rule of Five, ChemDiv1_008554 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 ChemDiv1_008554?
The CAS number of ChemDiv1_008554 is 315702-37-5.
What is the molecular formula of ChemDiv1_008554?
The molecular formula of ChemDiv1_008554 is C19H25N3O2S2.
What is the molecular weight of ChemDiv1_008554?
The molecular weight of ChemDiv1_008554 is 391.14 g/mol.
Where can I buy ChemDiv1_008554?
You can request a quote for ChemDiv1_008554 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ChemDiv1_008554?
Yes, KEHONG BIO provides custom synthesis services for ChemDiv1_008554 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.