1,5-Dimethyl-2-phenyl-4-(quinazolin-4-ylamino)pyrazol-3-one
TL;DR: 1,5-Dimethyl-2-phenyl-4-(quinazolin-4-ylamino)pyrazol-3-one (CAS 100330-91-4) is a chemical compound with molecular formula C19H17N5O and molecular weight 331.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,5-dimethyl-2-phenyl-4-(quinazolin-4-ylamino)pyrazol-3-one
Also Known As: Quinazopyrine, 1,5-dimethyl-2-phenyl-4-(quinazolin-4-ylamino)pyrazol-3-one, 2,5-dimethyl-1-phenyl-4-(quinazolin-4-ylamino)pyrazol-3-one, 1,2-Dihydro-1,5-dimethyl-2-phenyl-4-(4-quinazolinylamino)-3H-pyrazol-3-one
| Molecular Formula | C19H17N5O |
|---|---|
| Molecular Weight | 331.14 g/mol |
| LogP | 3.7 |
| Topological Polar Surface Area | 61.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 331.1433 |
| Heavy Atoms | 25 |
| Complexity | 542.0 |
Chemical Identifiers
| CAS Number | 100330-91-4 |
|---|---|
| SMILES | CC1=C(C(=O)N(N1C)C2=CC=CC=C2)NC3=NC=NC4=CC=CC=C43 |
| InChIKey | NVIVNOZMKBAWMX-UHFFFAOYSA-N |
Product Overview
1,5-Dimethyl-2-phenyl-4-(quinazolin-4-ylamino)pyrazol-3-one (CAS 100330-91-4), with molecular formula C19H17N5O and molecular weight 331.14 g/mol. IUPAC: 1,5-dimethyl-2-phenyl-4-(quinazolin-4-ylamino)pyrazol-3-one.
Chemical Property Profile of 1,5-Dimethyl-2-phenyl-4-(quinazolin-4-ylamino)pyrazol-3-one
Property Insights of 1,5-Dimethyl-2-phenyl-4-(quinazolin-4-ylamino)pyrazol-3-one
The XLogP value of 3.7 indicates that 1,5-Dimethyl-2-phenyl-4-(quinazolin-4-ylamino)pyrazol-3-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 61.4 Ų falls within the moderate polarity range, balancing permeability and solubility for 1,5-Dimethyl-2-phenyl-4-(quinazolin-4-ylamino)pyrazol-3-one. Following Lipinski's Rule of Five, 1,5-Dimethyl-2-phenyl-4-(quinazolin-4-ylamino)pyrazol-3-one 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 1,5-Dimethyl-2-phenyl-4-(quinazolin-4-ylamino)pyrazol-3-one?
The CAS number of 1,5-Dimethyl-2-phenyl-4-(quinazolin-4-ylamino)pyrazol-3-one is 100330-91-4.
What is the molecular formula of 1,5-Dimethyl-2-phenyl-4-(quinazolin-4-ylamino)pyrazol-3-one?
The molecular formula of 1,5-Dimethyl-2-phenyl-4-(quinazolin-4-ylamino)pyrazol-3-one is C19H17N5O.
What is the molecular weight of 1,5-Dimethyl-2-phenyl-4-(quinazolin-4-ylamino)pyrazol-3-one?
The molecular weight of 1,5-Dimethyl-2-phenyl-4-(quinazolin-4-ylamino)pyrazol-3-one is 331.14 g/mol.
Where can I buy 1,5-Dimethyl-2-phenyl-4-(quinazolin-4-ylamino)pyrazol-3-one?
You can request a quote for 1,5-Dimethyl-2-phenyl-4-(quinazolin-4-ylamino)pyrazol-3-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,5-Dimethyl-2-phenyl-4-(quinazolin-4-ylamino)pyrazol-3-one?
Yes, KEHONG BIO provides custom synthesis services for 1,5-Dimethyl-2-phenyl-4-(quinazolin-4-ylamino)pyrazol-3-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.