2-Methyl-6-nitro-3-(phenylmethyl)-4(3H)-quinazolinone
TL;DR: 2-Methyl-6-nitro-3-(phenylmethyl)-4(3H)-quinazolinone (CAS 301667-91-4) is a chemical compound with molecular formula C16H13N3O3 and molecular weight 295.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-benzyl-2-methyl-6-nitroquinazolin-4-one
Also Known As: ASN 05276640, 3-benzyl-2-methyl-6-nitroquinazolin-4-one, 3-Benzyl-2-methyl-6-nitro-3H-quinazolin-4-one, 3-Benzyl-2-methyl-6-nitroquinazolin-4(3H)-one, 2-Methyl-6-nitro-3-(phenylmethyl)-4(3H)-quinazolinone
| Molecular Formula | C16H13N3O3 |
|---|---|
| Molecular Weight | 295.10 g/mol |
| LogP | 2.66142 |
| Topological Polar Surface Area | 78.03 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 295.0957 |
| Heavy Atoms | 22 |
| Complexity | 917.0625 |
Chemical Identifiers
| CAS Number | 301667-91-4 |
|---|---|
| SMILES | CC1=NC2=C(C=C(C=C2)[N+](=O)[O-])C(=O)N1CC3=CC=CC=C3 |
Product Overview
2-Methyl-6-nitro-3-(phenylmethyl)-4(3H)-quinazolinone (CAS 301667-91-4), with molecular formula C16H13N3O3 and molecular weight 295.10 g/mol. IUPAC: 3-benzyl-2-methyl-6-nitroquinazolin-4-one.
Chemical Property Profile of 2-Methyl-6-nitro-3-(phenylmethyl)-4(3H)-quinazolinone
Property Insights of 2-Methyl-6-nitro-3-(phenylmethyl)-4(3H)-quinazolinone
The XLogP value of 2.66142 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Methyl-6-nitro-3-(phenylmethyl)-4(3H)-quinazolinone. The TPSA of 78.03 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-Methyl-6-nitro-3-(phenylmethyl)-4(3H)-quinazolinone. Following Lipinski's Rule of Five, 2-Methyl-6-nitro-3-(phenylmethyl)-4(3H)-quinazolinone has 0 hydrogen bond donor(s) and 4 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 2-Methyl-6-nitro-3-(phenylmethyl)-4(3H)-quinazolinone?
The CAS number of 2-Methyl-6-nitro-3-(phenylmethyl)-4(3H)-quinazolinone is 301667-91-4.
What is the molecular formula of 2-Methyl-6-nitro-3-(phenylmethyl)-4(3H)-quinazolinone?
The molecular formula of 2-Methyl-6-nitro-3-(phenylmethyl)-4(3H)-quinazolinone is C16H13N3O3.
What is the molecular weight of 2-Methyl-6-nitro-3-(phenylmethyl)-4(3H)-quinazolinone?
The molecular weight of 2-Methyl-6-nitro-3-(phenylmethyl)-4(3H)-quinazolinone is 295.10 g/mol.
Where can I buy 2-Methyl-6-nitro-3-(phenylmethyl)-4(3H)-quinazolinone?
You can request a quote for 2-Methyl-6-nitro-3-(phenylmethyl)-4(3H)-quinazolinone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Methyl-6-nitro-3-(phenylmethyl)-4(3H)-quinazolinone?
Yes, KEHONG BIO provides custom synthesis services for 2-Methyl-6-nitro-3-(phenylmethyl)-4(3H)-quinazolinone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.