4-(benzylamino)-1H-quinazoline-2-thione
TL;DR: 4-(benzylamino)-1H-quinazoline-2-thione (CAS 120394-26-5) is a chemical compound with molecular formula C15H13N3S and molecular weight 267.083 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
4-(benzylamino)-1H-quinazoline-2-thione
Also Known As: 4-(benzylamino)-1H-quinazoline-2-thione, 4-(benzylamino)quinazoline-2(1H)-thione, 4-(benzylamino)-1,2-dihydroquinazoline-2-thione, F0919-6656
Technical Specifications
| Molecular Formula | C15H13N3S |
| Molecular Weight | 267.083 g/mol |
| XLogP | 2.6 |
| Topological Polar Surface Area (TPSA) | 68.5 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 3 |
| Exact Mass | 267.083 Da |
| Heavy Atoms | 19 |
| Complexity | 360.0 |
| SMILES | C1=CC=C(C=C1)CNC2=NC(=S)NC3=CC=CC=C32 |
| InChIKey | SBILQQZKPSMLGF-UHFFFAOYSA-N |
Chemical Property Profile of 4-(benzylamino)-1H-quinazoline-2-thione
Property Insights of 4-(benzylamino)-1H-quinazoline-2-thione
The XLogP value of 2.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-(benzylamino)-1H-quinazoline-2-thione. The TPSA of 68.5 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-(benzylamino)-1H-quinazoline-2-thione. Following Lipinski's Rule of Five, 4-(benzylamino)-1H-quinazoline-2-thione has 2 hydrogen bond donor(s) and 1 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 4-(benzylamino)-1H-quinazoline-2-thione?
The CAS number of 4-(benzylamino)-1H-quinazoline-2-thione is 120394-26-5.
What is the molecular formula of 4-(benzylamino)-1H-quinazoline-2-thione?
The molecular formula of 4-(benzylamino)-1H-quinazoline-2-thione is C15H13N3S.
What is the molecular weight of 4-(benzylamino)-1H-quinazoline-2-thione?
The molecular weight of 4-(benzylamino)-1H-quinazoline-2-thione is 267.083 g/mol.
Where can I buy 4-(benzylamino)-1H-quinazoline-2-thione?
You can request a quote for 4-(benzylamino)-1H-quinazoline-2-thione directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 4-(benzylamino)-1H-quinazoline-2-thione?
Yes, CoreyChem provides custom synthesis services for 4-(benzylamino)-1H-quinazoline-2-thione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.