C30H33N5O2
TL;DR: C30H33N5O2 (CAS 799768-86-8) is a chemical compound with molecular formula C30H33N5O2 and molecular weight 495.26 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(E)-3-[2-(4-benzylpiperidin-1-yl)-4-oxopyrido[1,2-a]pyrimidin-3-yl]-2-cyano-N-cyclohexylprop-2-enamide
Also Known As: (2E)-3-[2-(4-benzylpiperidin-1-yl)-4-oxo-4H-pyrido[1,2-a]pyrimidin-3-yl]-2-cyano-N-cyclohexylprop-2-enamide, (E)-3-(2-(4-benzylpiperidin-1-yl)-4-oxo-4H-pyrido[1,2-a]pyrimidin-3-yl)-2-cyano-N-cyclohexylacrylamide, (E)-3-[2-(4-benzylpiperidin-1-yl)-4-oxopyrido[1,2-a]pyrimidin-3-yl]-2-cyano-N-cyclohexylprop-2-enamide
| Molecular Formula | C30H33N5O2 |
|---|---|
| Molecular Weight | 495.26 g/mol |
| LogP | 4.50948 |
| Topological Polar Surface Area | 90.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 495.26343 |
| Heavy Atoms | 37 |
| Complexity | 1374.5874 |
Chemical Identifiers
| CAS Number | 799768-86-8 |
|---|---|
| SMILES | C1CCC(CC1)NC(=O)/C(=C/C2=C(N=C3C=CC=CN3C2=O)N4CCC(CC4)CC5=CC=CC=C5)/C#N |
Product Overview
C30H33N5O2 (CAS 799768-86-8), with molecular formula C30H33N5O2 and molecular weight 495.26 g/mol. IUPAC: (E)-3-[2-(4-benzylpiperidin-1-yl)-4-oxopyrido[1,2-a]pyrimidin-3-yl]-2-cyano-N-cyclohexylprop-2-enamide.
Chemical Property Profile of C30H33N5O2
Property Insights of C30H33N5O2
The XLogP value of 4.50948 indicates that C30H33N5O2 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 90.5 Ų falls within the moderate polarity range, balancing permeability and solubility for C30H33N5O2. Following Lipinski's Rule of Five, C30H33N5O2 has 1 hydrogen bond donor(s) and 5 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 C30H33N5O2?
The CAS number of C30H33N5O2 is 799768-86-8.
What is the molecular formula of C30H33N5O2?
The molecular formula of C30H33N5O2 is C30H33N5O2.
What is the molecular weight of C30H33N5O2?
The molecular weight of C30H33N5O2 is 495.26 g/mol.
Where can I buy C30H33N5O2?
You can request a quote for C30H33N5O2 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for C30H33N5O2?
Yes, KEHONG BIO provides custom synthesis services for C30H33N5O2 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.