ChemDiv1_016361
TL;DR: ChemDiv1_016361 (CAS 423138-95-8) is a chemical compound with molecular formula C23H17ClN4OS and molecular weight 432.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-chloro-11-(4-methylphenyl)-9-thiophen-2-yl-8-oxa-12,13,15,17-tetrazatetracyclo[8.7.0.02,7.012,16]heptadeca-1(10),2,4,6,13,15-hexaene
Also Known As: ChemDiv1_016361, 2-chloro-7-(4-methylphenyl)-6-(thiophen-2-yl)-7,12-dihydro-6H-chromeno[4,3-d][1,2,4]triazolo[1,5-a]pyrimidine, 2-chloro-6-(thiophen-2-yl)-7-(p-tolyl)-7,12-dihydro-6H-chromeno[4,3-d][1,2,4]triazolo[1,5-a]pyrimidine, 2-CHLORO-7-(4-METHYLPHENYL)-6-(2-THIENYL)-7,12-DIHYDRO-6H-CHROMENO[4,3-D][1,2,4]TRIAZOLO[1,5-A]PYRIMIDINE
| Molecular Formula | C23H17ClN4OS |
|---|---|
| Molecular Weight | 432.08 g/mol |
| LogP | 5.86132 |
| Topological Polar Surface Area | 51.97 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 432.08115 |
| Heavy Atoms | 30 |
| Complexity | 1277.0476 |
Chemical Identifiers
| CAS Number | 423138-95-8 |
|---|---|
| SMILES | CC1=CC=C(C=C1)C2C3=C(C4=C(C=CC(=C4)Cl)OC3C5=CC=CS5)NC6=NC=NN26 |
Product Overview
ChemDiv1_016361 (CAS 423138-95-8), with molecular formula C23H17ClN4OS and molecular weight 432.08 g/mol. IUPAC: 4-chloro-11-(4-methylphenyl)-9-thiophen-2-yl-8-oxa-12,13,15,17-tetrazatetracyclo[8.7.0.02,7.012,16]heptadeca-1(10),2,4,6,13,15-hexaene.
Chemical Property Profile of ChemDiv1_016361
Property Insights of ChemDiv1_016361
The XLogP value of 5.86132 indicates that ChemDiv1_016361 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 51.97 Ų, ChemDiv1_016361 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, ChemDiv1_016361 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_016361?
The CAS number of ChemDiv1_016361 is 423138-95-8.
What is the molecular formula of ChemDiv1_016361?
The molecular formula of ChemDiv1_016361 is C23H17ClN4OS.
What is the molecular weight of ChemDiv1_016361?
The molecular weight of ChemDiv1_016361 is 432.08 g/mol.
Where can I buy ChemDiv1_016361?
You can request a quote for ChemDiv1_016361 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ChemDiv1_016361?
Yes, KEHONG BIO provides custom synthesis services for ChemDiv1_016361 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.