ChemDiv1_005163
TL;DR: ChemDiv1_005163 (CAS 329795-99-5) is a chemical compound with molecular formula C18H15N7O3 and molecular weight 377.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-methyl-7-(3-nitrophenyl)-N-pyridin-2-yl-4,7-dihydro-[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxamide
Also Known As: ChemDiv1_005163, F0497-0047, 5-methyl-7-(3-nitrophenyl)-N-(pyridin-2-yl)-4,7-dihydro-[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxamide, 5-METHYL-7-(3-NITROPHENYL)-N-(PYRIDIN-2-YL)-4H,7H-[1,2,4]TRIAZOLO[1,5-A]PYRIMIDINE-6-CARBOXAMIDE, 5-methyl-7-(3-nitrophenyl)-N-pyridin-2-yl-1,7-dihydro-[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxamide
| Molecular Formula | C18H15N7O3 |
|---|---|
| Molecular Weight | 377.12 g/mol |
| LogP | 2.5089 |
| Topological Polar Surface Area | 127.87 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 4 |
| Exact Mass | 377.12363 |
| Heavy Atoms | 28 |
| Complexity | 1091.3234 |
Chemical Identifiers
| CAS Number | 329795-99-5 |
|---|---|
| SMILES | CC1=C(C(N2C(=NC=N2)N1)C3=CC(=CC=C3)[N+](=O)[O-])C(=O)NC4=CC=CC=N4 |
Product Overview
ChemDiv1_005163 (CAS 329795-99-5), with molecular formula C18H15N7O3 and molecular weight 377.12 g/mol. IUPAC: 5-methyl-7-(3-nitrophenyl)-N-pyridin-2-yl-4,7-dihydro-[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxamide.
Chemical Property Profile of ChemDiv1_005163
Property Insights of ChemDiv1_005163
The XLogP value of 2.5089 suggests moderate lipophilicity, balancing water solubility and membrane permeability for ChemDiv1_005163. The TPSA of 127.87 Ų falls within the moderate polarity range, balancing permeability and solubility for ChemDiv1_005163. Following Lipinski's Rule of Five, ChemDiv1_005163 has 2 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 ChemDiv1_005163?
The CAS number of ChemDiv1_005163 is 329795-99-5.
What is the molecular formula of ChemDiv1_005163?
The molecular formula of ChemDiv1_005163 is C18H15N7O3.
What is the molecular weight of ChemDiv1_005163?
The molecular weight of ChemDiv1_005163 is 377.12 g/mol.
Where can I buy ChemDiv1_005163?
You can request a quote for ChemDiv1_005163 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ChemDiv1_005163?
Yes, KEHONG BIO provides custom synthesis services for ChemDiv1_005163 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.