ChemDiv3_002637
TL;DR: ChemDiv3_002637 (CAS 434313-47-0) is a chemical compound with molecular formula C18H18N2O3 and molecular weight 310.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(3,5-dioxo-4-azatricyclo[5.2.1.02,6]dec-8-en-4-yl)-N-phenylpropanamide
Also Known As: ChemDiv3_002637, BAS 01506799, BRD-A56823057-001-01-5, 3-(1,3-dioxo-1,3,3a,4,7,7a-hexahydro-2H-4,7-methanoisoindol-2-yl)-N-phenylpropanamide, 3-(1,3-dioxo-3a,4,7,7a-tetrahydro-1H-4,7-methanoisoindol-2(3H)-yl)-N-phenylpropanamide
| Molecular Formula | C18H18N2O3 |
|---|---|
| Molecular Weight | 310.13 g/mol |
| LogP | 1.8223 |
| Topological Polar Surface Area | 66.48 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 310.13174 |
| Heavy Atoms | 23 |
| Complexity | 667.4781 |
Chemical Identifiers
| CAS Number | 434313-47-0 |
|---|---|
| SMILES | C1C2C=CC1C3C2C(=O)N(C3=O)CCC(=O)NC4=CC=CC=C4 |
Product Overview
ChemDiv3_002637 (CAS 434313-47-0), with molecular formula C18H18N2O3 and molecular weight 310.13 g/mol. IUPAC: 3-(3,5-dioxo-4-azatricyclo[5.2.1.02,6]dec-8-en-4-yl)-N-phenylpropanamide.
Chemical Property Profile of ChemDiv3_002637
Property Insights of ChemDiv3_002637
The XLogP value of 1.8223 suggests moderate lipophilicity, balancing water solubility and membrane permeability for ChemDiv3_002637. The TPSA of 66.48 Ų falls within the moderate polarity range, balancing permeability and solubility for ChemDiv3_002637. Following Lipinski's Rule of Five, ChemDiv3_002637 has 1 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 ChemDiv3_002637?
The CAS number of ChemDiv3_002637 is 434313-47-0.
What is the molecular formula of ChemDiv3_002637?
The molecular formula of ChemDiv3_002637 is C18H18N2O3.
What is the molecular weight of ChemDiv3_002637?
The molecular weight of ChemDiv3_002637 is 310.13 g/mol.
Where can I buy ChemDiv3_002637?
You can request a quote for ChemDiv3_002637 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ChemDiv3_002637?
Yes, KEHONG BIO provides custom synthesis services for ChemDiv3_002637 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.