ChemDiv1_004922
TL;DR: ChemDiv1_004922 (CAS 315239-08-8) is a chemical compound with molecular formula C18H27N3O2S2 and molecular weight 381.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N,N-dibutyl-2-[(5,6-dimethyl-4-oxo-3H-thieno[2,3-d]pyrimidin-2-yl)sulfanyl]acetamide
Also Known As: ChemDiv1_004922, BIM-0001987.P001, AF-399/14606066, N,N-dibutyl-2-[(5,6-dimethyl-4-oxo-3,4-dihydrothieno[2,3-d]pyrimidin-2-yl)sulfanyl]acetamide, F0786-0003
| Molecular Formula | C18H27N3O2S2 |
|---|---|
| Molecular Weight | 381.15 g/mol |
| LogP | 4.12234 |
| Topological Polar Surface Area | 66.06 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 9 |
| Exact Mass | 381.15448 |
| Heavy Atoms | 25 |
| Complexity | 774.4545 |
Chemical Identifiers
| CAS Number | 315239-08-8 |
|---|---|
| SMILES | CCCCN(CCCC)C(=O)CSC1=NC2=C(C(=C(S2)C)C)C(=O)N1 |
Product Overview
ChemDiv1_004922 (CAS 315239-08-8), with molecular formula C18H27N3O2S2 and molecular weight 381.15 g/mol. IUPAC: N,N-dibutyl-2-[(5,6-dimethyl-4-oxo-3H-thieno[2,3-d]pyrimidin-2-yl)sulfanyl]acetamide.
Chemical Property Profile of ChemDiv1_004922
Property Insights of ChemDiv1_004922
The XLogP value of 4.12234 indicates that ChemDiv1_004922 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 66.06 Ų falls within the moderate polarity range, balancing permeability and solubility for ChemDiv1_004922. Following Lipinski's Rule of Five, ChemDiv1_004922 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_004922?
The CAS number of ChemDiv1_004922 is 315239-08-8.
What is the molecular formula of ChemDiv1_004922?
The molecular formula of ChemDiv1_004922 is C18H27N3O2S2.
What is the molecular weight of ChemDiv1_004922?
The molecular weight of ChemDiv1_004922 is 381.15 g/mol.
Where can I buy ChemDiv1_004922?
You can request a quote for ChemDiv1_004922 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ChemDiv1_004922?
Yes, KEHONG BIO provides custom synthesis services for ChemDiv1_004922 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.