1,4-Dihydro-4,6,7-trimethyl-8-quinazolinecarbonitrile
TL;DR: 1,4-Dihydro-4,6,7-trimethyl-8-quinazolinecarbonitrile (CAS 73318-20-4) is a chemical compound with molecular formula C12H13N3 and molecular weight 199.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4,6,7-trimethyl-1,4-dihydroquinazoline-8-carbonitrile
Also Known As: 1,4-Dihydro-4,6,7-trimethyl-8-quinazolinecarbonitrile, 4,6,7-trimethyl-1,4-dihydroquinazoline-8-carbonitrile, 4,6,7-trimethyl-3,4-dihydroquinazoline-8-carbonitrile, 8-Quinazolinecarbonitrile, 1,4-dihydro-4,6,7-trimethyl-, 8-QUINAZOLINECARBONITRILE,1,4-DIHYDRO-4,6,7-TRIMETHYL-
| Molecular Formula | C12H13N3 |
|---|---|
| Molecular Weight | 199.11 g/mol |
| LogP | 1.6 |
| Topological Polar Surface Area | 48.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 199.11095 |
| Heavy Atoms | 15 |
| Complexity | 314.0 |
Chemical Identifiers
| CAS Number | 73318-20-4 |
|---|---|
| SMILES | CC1C2=C(C(=C(C(=C2)C)C)C#N)NC=N1 |
| InChIKey | JZZVVNQVOVKBRU-UHFFFAOYSA-N |
Product Overview
1,4-Dihydro-4,6,7-trimethyl-8-quinazolinecarbonitrile (CAS 73318-20-4), with molecular formula C12H13N3 and molecular weight 199.11 g/mol. IUPAC: 4,6,7-trimethyl-1,4-dihydroquinazoline-8-carbonitrile.
Chemical Property Profile of 1,4-Dihydro-4,6,7-trimethyl-8-quinazolinecarbonitrile
Property Insights of 1,4-Dihydro-4,6,7-trimethyl-8-quinazolinecarbonitrile
The XLogP value of 1.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1,4-Dihydro-4,6,7-trimethyl-8-quinazolinecarbonitrile. With a topological polar surface area (TPSA) of 48.2 Ų, 1,4-Dihydro-4,6,7-trimethyl-8-quinazolinecarbonitrile exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,4-Dihydro-4,6,7-trimethyl-8-quinazolinecarbonitrile 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 1,4-Dihydro-4,6,7-trimethyl-8-quinazolinecarbonitrile?
The CAS number of 1,4-Dihydro-4,6,7-trimethyl-8-quinazolinecarbonitrile is 73318-20-4.
What is the molecular formula of 1,4-Dihydro-4,6,7-trimethyl-8-quinazolinecarbonitrile?
The molecular formula of 1,4-Dihydro-4,6,7-trimethyl-8-quinazolinecarbonitrile is C12H13N3.
What is the molecular weight of 1,4-Dihydro-4,6,7-trimethyl-8-quinazolinecarbonitrile?
The molecular weight of 1,4-Dihydro-4,6,7-trimethyl-8-quinazolinecarbonitrile is 199.11 g/mol.
Where can I buy 1,4-Dihydro-4,6,7-trimethyl-8-quinazolinecarbonitrile?
You can request a quote for 1,4-Dihydro-4,6,7-trimethyl-8-quinazolinecarbonitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,4-Dihydro-4,6,7-trimethyl-8-quinazolinecarbonitrile?
Yes, KEHONG BIO provides custom synthesis services for 1,4-Dihydro-4,6,7-trimethyl-8-quinazolinecarbonitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.