N-allyl-2,4-diphenyl-5-pyrimidinecarboxamide
TL;DR: N-allyl-2,4-diphenyl-5-pyrimidinecarboxamide (CAS 338771-89-4) is a chemical compound with molecular formula C20H17N3O and molecular weight 315.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,4-diphenyl-N-prop-2-enylpyrimidine-5-carboxamide
Also Known As: N-allyl-2,4-diphenyl-5-pyrimidinecarboxamide, 2,4-diphenyl-N-prop-2-enylpyrimidine-5-carboxamide, 2,4-diphenyl-N-(prop-2-en-1-yl)pyrimidine-5-carboxamide
| Molecular Formula | C20H17N3O |
|---|---|
| Molecular Weight | 315.14 g/mol |
| LogP | 3.7264 |
| Topological Polar Surface Area | 54.88 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 315.13718 |
| Heavy Atoms | 24 |
| Complexity | 845.27264 |
Chemical Identifiers
| CAS Number | 338771-89-4 |
|---|---|
| SMILES | C=CCNC(=O)C1=CN=C(N=C1C2=CC=CC=C2)C3=CC=CC=C3 |
Product Overview
N-allyl-2,4-diphenyl-5-pyrimidinecarboxamide (CAS 338771-89-4), with molecular formula C20H17N3O and molecular weight 315.14 g/mol. IUPAC: 2,4-diphenyl-N-prop-2-enylpyrimidine-5-carboxamide.
Chemical Property Profile of N-allyl-2,4-diphenyl-5-pyrimidinecarboxamide
Property Insights of N-allyl-2,4-diphenyl-5-pyrimidinecarboxamide
The XLogP value of 3.7264 indicates that N-allyl-2,4-diphenyl-5-pyrimidinecarboxamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 54.88 Ų, N-allyl-2,4-diphenyl-5-pyrimidinecarboxamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-allyl-2,4-diphenyl-5-pyrimidinecarboxamide 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 N-allyl-2,4-diphenyl-5-pyrimidinecarboxamide?
The CAS number of N-allyl-2,4-diphenyl-5-pyrimidinecarboxamide is 338771-89-4.
What is the molecular formula of N-allyl-2,4-diphenyl-5-pyrimidinecarboxamide?
The molecular formula of N-allyl-2,4-diphenyl-5-pyrimidinecarboxamide is C20H17N3O.
What is the molecular weight of N-allyl-2,4-diphenyl-5-pyrimidinecarboxamide?
The molecular weight of N-allyl-2,4-diphenyl-5-pyrimidinecarboxamide is 315.14 g/mol.
Where can I buy N-allyl-2,4-diphenyl-5-pyrimidinecarboxamide?
You can request a quote for N-allyl-2,4-diphenyl-5-pyrimidinecarboxamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-allyl-2,4-diphenyl-5-pyrimidinecarboxamide?
Yes, KEHONG BIO provides custom synthesis services for N-allyl-2,4-diphenyl-5-pyrimidinecarboxamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.