ChemDiv1_021805
TL;DR: ChemDiv1_021805 (CAS 122062-47-9) is a chemical compound with molecular formula C19H18N4O and molecular weight 318.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
16-morpholin-4-yl-1,8-diazatetracyclo[7.7.0.02,7.011,15]hexadeca-2,4,6,8,10,15-hexaene-10-carbonitrile
Also Known As: ChemDiv1_021805, BAS 00312784, 11-(4-morpholinyl)-2,3-dihydro-1H-cyclopenta[4,5]pyrido[1,2-a]benzimidazole-4-carbonitrile, AB00100156-01, AF-399/36011053
| Molecular Formula | C19H18N4O |
|---|---|
| Molecular Weight | 318.15 g/mol |
| LogP | 3.8 |
| Topological Polar Surface Area | 53.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 318.14807 |
| Heavy Atoms | 24 |
| Complexity | 525.0 |
Chemical Identifiers
| CAS Number | 122062-47-9 |
|---|---|
| SMILES | C1CC2=C(C3=NC4=CC=CC=C4N3C(=C2C1)N5CCOCC5)C#N |
| InChIKey | PKNJUWQZBNJAOP-UHFFFAOYSA-N |
Product Overview
ChemDiv1_021805 (CAS 122062-47-9), with molecular formula C19H18N4O and molecular weight 318.15 g/mol. IUPAC: 16-morpholin-4-yl-1,8-diazatetracyclo[7.7.0.02,7.011,15]hexadeca-2,4,6,8,10,15-hexaene-10-carbonitrile.
Chemical Property Profile of ChemDiv1_021805
Property Insights of ChemDiv1_021805
The XLogP value of 3.8 indicates that ChemDiv1_021805 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 53.6 Ų, ChemDiv1_021805 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, ChemDiv1_021805 has 0 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 ChemDiv1_021805?
The CAS number of ChemDiv1_021805 is 122062-47-9.
What is the molecular formula of ChemDiv1_021805?
The molecular formula of ChemDiv1_021805 is C19H18N4O.
What is the molecular weight of ChemDiv1_021805?
The molecular weight of ChemDiv1_021805 is 318.15 g/mol.
Where can I buy ChemDiv1_021805?
You can request a quote for ChemDiv1_021805 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ChemDiv1_021805?
Yes, KEHONG BIO provides custom synthesis services for ChemDiv1_021805 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.