4(3H)-Quinazolinone, 3-(4-(p-nitrophenyl)-1-piperazinylmethyl)-, dihydrochloride
TL;DR: 4(3H)-Quinazolinone, 3-(4-(p-nitrophenyl)-1-piperazinylmethyl)-, dihydrochloride (CAS 68638-35-7) is a chemical compound with molecular formula C19H21Cl2N5O3 and molecular weight 437.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[[4-(4-nitrophenyl)piperazin-1-yl]methyl]quinazolin-4-one;dihydrochloride
Also Known As: 4(3H)-Quinazolinone, 3-(4-(p-nitrophenyl)-1-piperazinylmethyl)-, dihydrochloride, 3-(4-(p-Nitrophenyl)-1-piperazinylmethyl)-4(3H)-quinazolinone dihydrochloride, 3-[[4-(4-nitrophenyl)piperazin-1-yl]methyl]quinazolin-4-one dihydrochloride, 3-{[4-(4-Nitrophenyl)piperazin-1-yl]methyl}quinazolin-4(3H)-one--hydrogen chloride (1/2), RefChem:284069
| Molecular Formula | C19H21Cl2N5O3 |
|---|---|
| Molecular Weight | 437.10 g/mol |
| LogP | 2.93 |
| Topological Polar Surface Area | 85.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Exact Mass | 437.10214 |
| Heavy Atoms | 29 |
| Complexity | 576.0 |
Chemical Identifiers
| CAS Number | 68638-35-7 |
|---|---|
| SMILES | C1CN(CCN1CN2C=NC3=CC=CC=C3C2=O)C4=CC=C(C=C4)[N+](=O)[O-].Cl.Cl |
| InChIKey | LOUCFQGVNXUXNS-UHFFFAOYSA-N |
Product Overview
4(3H)-Quinazolinone, 3-(4-(p-nitrophenyl)-1-piperazinylmethyl)-, dihydrochloride (CAS 68638-35-7), with molecular formula C19H21Cl2N5O3 and molecular weight 437.10 g/mol. IUPAC: 3-[[4-(4-nitrophenyl)piperazin-1-yl]methyl]quinazolin-4-one;dihydrochloride.
Chemical Property Profile of 4(3H)-Quinazolinone, 3-(4-(p-nitrophenyl)-1-piperazinylmethyl)-, dihydrochloride
Property Insights of 4(3H)-Quinazolinone, 3-(4-(p-nitrophenyl)-1-piperazinylmethyl)-, dihydrochloride
The XLogP value of 2.93 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4(3H)-Quinazolinone, 3-(4-(p-nitrophenyl)-1-piperazinylmethyl)-, dihydrochloride. The TPSA of 85.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 4(3H)-Quinazolinone, 3-(4-(p-nitrophenyl)-1-piperazinylmethyl)-, dihydrochloride. Following Lipinski's Rule of Five, 4(3H)-Quinazolinone, 3-(4-(p-nitrophenyl)-1-piperazinylmethyl)-, dihydrochloride has 2 hydrogen bond donor(s) and 6 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 4(3H)-Quinazolinone, 3-(4-(p-nitrophenyl)-1-piperazinylmethyl)-, dihydrochloride?
The CAS number of 4(3H)-Quinazolinone, 3-(4-(p-nitrophenyl)-1-piperazinylmethyl)-, dihydrochloride is 68638-35-7.
What is the molecular formula of 4(3H)-Quinazolinone, 3-(4-(p-nitrophenyl)-1-piperazinylmethyl)-, dihydrochloride?
The molecular formula of 4(3H)-Quinazolinone, 3-(4-(p-nitrophenyl)-1-piperazinylmethyl)-, dihydrochloride is C19H21Cl2N5O3.
What is the molecular weight of 4(3H)-Quinazolinone, 3-(4-(p-nitrophenyl)-1-piperazinylmethyl)-, dihydrochloride?
The molecular weight of 4(3H)-Quinazolinone, 3-(4-(p-nitrophenyl)-1-piperazinylmethyl)-, dihydrochloride is 437.10 g/mol.
Where can I buy 4(3H)-Quinazolinone, 3-(4-(p-nitrophenyl)-1-piperazinylmethyl)-, dihydrochloride?
You can request a quote for 4(3H)-Quinazolinone, 3-(4-(p-nitrophenyl)-1-piperazinylmethyl)-, dihydrochloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4(3H)-Quinazolinone, 3-(4-(p-nitrophenyl)-1-piperazinylmethyl)-, dihydrochloride?
Yes, KEHONG BIO provides custom synthesis services for 4(3H)-Quinazolinone, 3-(4-(p-nitrophenyl)-1-piperazinylmethyl)-, dihydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.