4(3H)-Quinazolinone, 3-(1H-indol-3-ylmethyl)-2-methyl-
TL;DR: 4(3H)-Quinazolinone, 3-(1H-indol-3-ylmethyl)-2-methyl- (CAS 88514-47-0) is a chemical compound with molecular formula C18H15N3O and molecular weight 289.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(1H-indol-3-ylmethyl)-2-methylquinazolin-4-one
Also Known As: 4(3H)-Quinazolinone, 3-(1H-indol-3-ylmethyl)-2-methyl-, 3-(1H-Indol-3-ylmethyl)-2-methyl-4(3H)-quinazolinone, 3-(1H-indol-3-ylmethyl)-2-methylquinazolin-4-one, 4(3H)-Quinazolinone, 3-(1H-indol-3-yl)methyl)-, 3-[(1H-Indol-3-yl)methyl]-2-methylquinazolin-4(3H)-one
| Molecular Formula | C18H15N3O |
|---|---|
| Molecular Weight | 289.12 g/mol |
| LogP | 2.5 |
| Topological Polar Surface Area | 48.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 289.12152 |
| Heavy Atoms | 22 |
| Complexity | 475.0 |
Chemical Identifiers
| CAS Number | 88514-47-0 |
|---|---|
| SMILES | CC1=NC2=CC=CC=C2C(=O)N1CC3=CNC4=CC=CC=C43 |
| InChIKey | FDNGYEHPOBXZAF-UHFFFAOYSA-N |
Product Overview
4(3H)-Quinazolinone, 3-(1H-indol-3-ylmethyl)-2-methyl- (CAS 88514-47-0), with molecular formula C18H15N3O and molecular weight 289.12 g/mol. IUPAC: 3-(1H-indol-3-ylmethyl)-2-methylquinazolin-4-one.
Chemical Property Profile of 4(3H)-Quinazolinone, 3-(1H-indol-3-ylmethyl)-2-methyl-
Property Insights of 4(3H)-Quinazolinone, 3-(1H-indol-3-ylmethyl)-2-methyl-
The XLogP value of 2.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4(3H)-Quinazolinone, 3-(1H-indol-3-ylmethyl)-2-methyl-. With a topological polar surface area (TPSA) of 48.5 Ų, 4(3H)-Quinazolinone, 3-(1H-indol-3-ylmethyl)-2-methyl- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4(3H)-Quinazolinone, 3-(1H-indol-3-ylmethyl)-2-methyl- has 1 hydrogen bond donor(s) and 2 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-(1H-indol-3-ylmethyl)-2-methyl-?
The CAS number of 4(3H)-Quinazolinone, 3-(1H-indol-3-ylmethyl)-2-methyl- is 88514-47-0.
What is the molecular formula of 4(3H)-Quinazolinone, 3-(1H-indol-3-ylmethyl)-2-methyl-?
The molecular formula of 4(3H)-Quinazolinone, 3-(1H-indol-3-ylmethyl)-2-methyl- is C18H15N3O.
What is the molecular weight of 4(3H)-Quinazolinone, 3-(1H-indol-3-ylmethyl)-2-methyl-?
The molecular weight of 4(3H)-Quinazolinone, 3-(1H-indol-3-ylmethyl)-2-methyl- is 289.12 g/mol.
Where can I buy 4(3H)-Quinazolinone, 3-(1H-indol-3-ylmethyl)-2-methyl-?
You can request a quote for 4(3H)-Quinazolinone, 3-(1H-indol-3-ylmethyl)-2-methyl- 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-(1H-indol-3-ylmethyl)-2-methyl-?
Yes, KEHONG BIO provides custom synthesis services for 4(3H)-Quinazolinone, 3-(1H-indol-3-ylmethyl)-2-methyl- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.