ChemDiv1_008252
TL;DR: ChemDiv1_008252 (CAS 315693-05-1) is a chemical compound with molecular formula C22H19N3OS2 and molecular weight 405.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(10-methyl-7-thia-9,11-diazatricyclo[6.4.0.02,6]dodeca-1(8),2(6),9,11-tetraen-12-yl)sulfanyl]-N-naphthalen-2-ylacetamide
Also Known As: ChemDiv1_008252, DivK1c_002892, CDS1_001852, VU0061004-1, AF-399/14945041
| Molecular Formula | C22H19N3OS2 |
|---|---|
| Molecular Weight | 405.10 g/mol |
| LogP | 5.37242 |
| Topological Polar Surface Area | 54.88 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 405.09695 |
| Heavy Atoms | 28 |
| Complexity | 1215.3337 |
Chemical Identifiers
| CAS Number | 315693-05-1 |
|---|---|
| SMILES | CC1=NC2=C(C3=C(S2)CCC3)C(=N1)SCC(=O)NC4=CC5=CC=CC=C5C=C4 |
Product Overview
ChemDiv1_008252 (CAS 315693-05-1), with molecular formula C22H19N3OS2 and molecular weight 405.10 g/mol. IUPAC: 2-[(10-methyl-7-thia-9,11-diazatricyclo[6.4.0.02,6]dodeca-1(8),2(6),9,11-tetraen-12-yl)sulfanyl]-N-naphthalen-2-ylacetamide.
Chemical Property Profile of ChemDiv1_008252
Property Insights of ChemDiv1_008252
The XLogP value of 5.37242 indicates that ChemDiv1_008252 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 54.88 Ų, ChemDiv1_008252 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, ChemDiv1_008252 has 1 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of ChemDiv1_008252?
The CAS number of ChemDiv1_008252 is 315693-05-1.
What is the molecular formula of ChemDiv1_008252?
The molecular formula of ChemDiv1_008252 is C22H19N3OS2.
What is the molecular weight of ChemDiv1_008252?
The molecular weight of ChemDiv1_008252 is 405.10 g/mol.
Where can I buy ChemDiv1_008252?
You can request a quote for ChemDiv1_008252 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ChemDiv1_008252?
Yes, KEHONG BIO provides custom synthesis services for ChemDiv1_008252 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.