AB00668267-01
TL;DR: AB00668267-01 (CAS 440334-83-8) is a chemical compound with molecular formula C15H15N7O3 and molecular weight 341.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[(6-amino-5-nitropyrimidin-4-yl)amino]-1,5-dimethyl-2-phenylpyrazol-3-one
Also Known As: AB00668267-01, F0543-0171, 4-((6-amino-5-nitropyrimidin-4-yl)amino)-1,5-dimethyl-2-phenyl-1H-pyrazol-3(2H)-one, 4-[(6-amino-5-nitropyrimidin-4-yl)amino]-1,5-dimethyl-2-phenylpyrazol-3-one, 4-[(6-amino-5-nitropyrimidin-4-yl)amino]-1,5-dimethyl-2-phenyl-2,3-dihydro-1H-pyrazol-3-one
| Molecular Formula | C15H15N7O3 |
|---|---|
| Molecular Weight | 341.12 g/mol |
| LogP | 1.50842 |
| Topological Polar Surface Area | 133.9 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 4 |
| Exact Mass | 341.12363 |
| Heavy Atoms | 25 |
| Complexity | 1007.9547 |
Chemical Identifiers
| CAS Number | 440334-83-8 |
|---|---|
| SMILES | CC1=C(C(=O)N(N1C)C2=CC=CC=C2)NC3=NC=NC(=C3[N+](=O)[O-])N |
Product Overview
AB00668267-01 (CAS 440334-83-8), with molecular formula C15H15N7O3 and molecular weight 341.12 g/mol. IUPAC: 4-[(6-amino-5-nitropyrimidin-4-yl)amino]-1,5-dimethyl-2-phenylpyrazol-3-one.
Chemical Property Profile of AB00668267-01
Property Insights of AB00668267-01
The XLogP value of 1.50842 suggests moderate lipophilicity, balancing water solubility and membrane permeability for AB00668267-01. The TPSA of 133.9 Ų falls within the moderate polarity range, balancing permeability and solubility for AB00668267-01. Following Lipinski's Rule of Five, AB00668267-01 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 AB00668267-01?
The CAS number of AB00668267-01 is 440334-83-8.
What is the molecular formula of AB00668267-01?
The molecular formula of AB00668267-01 is C15H15N7O3.
What is the molecular weight of AB00668267-01?
The molecular weight of AB00668267-01 is 341.12 g/mol.
Where can I buy AB00668267-01?
You can request a quote for AB00668267-01 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AB00668267-01?
Yes, KEHONG BIO provides custom synthesis services for AB00668267-01 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.