ChemDiv2_001560
TL;DR: ChemDiv2_001560 (CAS 695193-01-2) is a chemical compound with molecular formula C19H22N2O3 and molecular weight 326.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-methyl-14-propyl-3,12-diazatetracyclo[10.3.1.13,14.05,10]heptadeca-5,7,9-triene-4,11,15-trione
Also Known As: ChemDiv2_001560, A3302/0140302, (2R,4R,6S)-4-methyl-6-propyl-3,4,6,7-tetrahydro-1H-2,6:4,8-dimethanobenzo[c][1,6]diazacycloundecine-1,5,9-trione, 1,10-Diazatetracyclo[10.3.1.1(10,14).0(3,8)]heptadeca-3,5,7-triene-2,9,13-trione, 12-methyl-14-propyl-, 1-METHYL-14-PROPYL-3,12-DIAZATETRACYCLO[10.3.1.1~3,14~.0~5,10~]HEPTADECA-5(10),6,8-TRIENE-4,11,15-TRIONE
| Molecular Formula | C19H22N2O3 |
|---|---|
| Molecular Weight | 326.16 g/mol |
| LogP | 1.5 |
| Topological Polar Surface Area | 57.7 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 326.16306 |
| Heavy Atoms | 24 |
| Complexity | 563.0 |
Chemical Identifiers
| CAS Number | 695193-01-2 |
|---|---|
| SMILES | CCCC12CN3CC(C1=O)(CN(C2)C(=O)C4=CC=CC=C4C3=O)C |
| InChIKey | BIJFXZKWKRJKOF-UHFFFAOYSA-N |
Product Overview
ChemDiv2_001560 (CAS 695193-01-2), with molecular formula C19H22N2O3 and molecular weight 326.16 g/mol. IUPAC: 1-methyl-14-propyl-3,12-diazatetracyclo[10.3.1.13,14.05,10]heptadeca-5,7,9-triene-4,11,15-trione.
Chemical Property Profile of ChemDiv2_001560
Property Insights of ChemDiv2_001560
The XLogP value of 1.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for ChemDiv2_001560. With a topological polar surface area (TPSA) of 57.7 Ų, ChemDiv2_001560 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, ChemDiv2_001560 has 0 hydrogen bond donor(s) and 3 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 ChemDiv2_001560?
The CAS number of ChemDiv2_001560 is 695193-01-2.
What is the molecular formula of ChemDiv2_001560?
The molecular formula of ChemDiv2_001560 is C19H22N2O3.
What is the molecular weight of ChemDiv2_001560?
The molecular weight of ChemDiv2_001560 is 326.16 g/mol.
Where can I buy ChemDiv2_001560?
You can request a quote for ChemDiv2_001560 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ChemDiv2_001560?
Yes, KEHONG BIO provides custom synthesis services for ChemDiv2_001560 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.