ethyl 1-[6-[(3-cyanophenyl)methyl]-2-methyl-7,8-dihydro-5H-pyrido[4,3-d]pyrimidin-4-yl]piperidine-4-carboxylate
TL;DR: ethyl 1-[6-[(3-cyanophenyl)methyl]-2-methyl-7,8-dihydro-5H-pyrido[4,3-d]pyrimidin-4-yl]piperidine-4-carboxylate (CAS 7243-33-6) is a chemical compound with molecular formula C24H29N5O2 and molecular weight 419.23 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 1-[6-[(3-cyanophenyl)methyl]-2-methyl-7,8-dihydro-5H-pyrido[4,3-d]pyrimidin-4-yl]piperidine-4-carboxylate
Also Known As: ethyl 1-[6-[(3-cyanophenyl)methyl]-2-methyl-7,8-dihydro-5H-pyrido[4,3-d]pyrimidin-4-yl]piperidine-4-carboxylate, Ethyl 1-{6-[(3-cyanophenyl)methyl]-2-methyl-5,6,7,8-tetrahydropyrido[4,3-d]pyrimidin-4-yl}piperidine-4-carboxylate
| Molecular Formula | C24H29N5O2 |
|---|---|
| Molecular Weight | 419.23 g/mol |
| LogP | 2.9945 |
| Topological Polar Surface Area | 82.35 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 5 |
| Exact Mass | 419.23212 |
| Heavy Atoms | 31 |
| Complexity | 991.9496 |
Chemical Identifiers
| CAS Number | 7243-33-6 |
|---|---|
| SMILES | CCOC(=O)C1CCN(CC1)C2=NC(=NC3=C2CN(CC3)CC4=CC(=CC=C4)C#N)C |
Product Overview
ethyl 1-[6-[(3-cyanophenyl)methyl]-2-methyl-7,8-dihydro-5H-pyrido[4,3-d]pyrimidin-4-yl]piperidine-4-carboxylate (CAS 7243-33-6), with molecular formula C24H29N5O2 and molecular weight 419.23 g/mol. IUPAC: ethyl 1-[6-[(3-cyanophenyl)methyl]-2-methyl-7,8-dihydro-5H-pyrido[4,3-d]pyrimidin-4-yl]piperidine-4-carboxylate.
Chemical Property Profile of ethyl 1-[6-[(3-cyanophenyl)methyl]-2-methyl-7,8-dihydro-5H-pyrido[4,3-d]pyrimidin-4-yl]piperidine-4-carboxylate
Property Insights of ethyl 1-[6-[(3-cyanophenyl)methyl]-2-methyl-7,8-dihydro-5H-pyrido[4,3-d]pyrimidin-4-yl]piperidine-4-carboxylate
The XLogP value of 2.9945 suggests moderate lipophilicity, balancing water solubility and membrane permeability for ethyl 1-[6-[(3-cyanophenyl)methyl]-2-methyl-7,8-dihydro-5H-pyrido[4,3-d]pyrimidin-4-yl]piperidine-4-carboxylate. The TPSA of 82.35 Ų falls within the moderate polarity range, balancing permeability and solubility for ethyl 1-[6-[(3-cyanophenyl)methyl]-2-methyl-7,8-dihydro-5H-pyrido[4,3-d]pyrimidin-4-yl]piperidine-4-carboxylate. Following Lipinski's Rule of Five, ethyl 1-[6-[(3-cyanophenyl)methyl]-2-methyl-7,8-dihydro-5H-pyrido[4,3-d]pyrimidin-4-yl]piperidine-4-carboxylate has 0 hydrogen bond donor(s) and 7 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 ethyl 1-[6-[(3-cyanophenyl)methyl]-2-methyl-7,8-dihydro-5H-pyrido[4,3-d]pyrimidin-4-yl]piperidine-4-carboxylate?
The CAS number of ethyl 1-[6-[(3-cyanophenyl)methyl]-2-methyl-7,8-dihydro-5H-pyrido[4,3-d]pyrimidin-4-yl]piperidine-4-carboxylate is 7243-33-6.
What is the molecular formula of ethyl 1-[6-[(3-cyanophenyl)methyl]-2-methyl-7,8-dihydro-5H-pyrido[4,3-d]pyrimidin-4-yl]piperidine-4-carboxylate?
The molecular formula of ethyl 1-[6-[(3-cyanophenyl)methyl]-2-methyl-7,8-dihydro-5H-pyrido[4,3-d]pyrimidin-4-yl]piperidine-4-carboxylate is C24H29N5O2.
What is the molecular weight of ethyl 1-[6-[(3-cyanophenyl)methyl]-2-methyl-7,8-dihydro-5H-pyrido[4,3-d]pyrimidin-4-yl]piperidine-4-carboxylate?
The molecular weight of ethyl 1-[6-[(3-cyanophenyl)methyl]-2-methyl-7,8-dihydro-5H-pyrido[4,3-d]pyrimidin-4-yl]piperidine-4-carboxylate is 419.23 g/mol.
Where can I buy ethyl 1-[6-[(3-cyanophenyl)methyl]-2-methyl-7,8-dihydro-5H-pyrido[4,3-d]pyrimidin-4-yl]piperidine-4-carboxylate?
You can request a quote for ethyl 1-[6-[(3-cyanophenyl)methyl]-2-methyl-7,8-dihydro-5H-pyrido[4,3-d]pyrimidin-4-yl]piperidine-4-carboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ethyl 1-[6-[(3-cyanophenyl)methyl]-2-methyl-7,8-dihydro-5H-pyrido[4,3-d]pyrimidin-4-yl]piperidine-4-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for ethyl 1-[6-[(3-cyanophenyl)methyl]-2-methyl-7,8-dihydro-5H-pyrido[4,3-d]pyrimidin-4-yl]piperidine-4-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.