2-Amino-7-phenyl-7,8-dihydro-6H-quinazolin-5-one

• Catalog Number: ACMA00001135
• Category: Amines
• Molecular Weight: 239.27
• Molecular Formula: C₁₄H₁₂ClN₃
• Hazard Statements: H302
• RIDADR: NONH for all modes of transport
• Symbol: GHS07

Custom Q&A

What is the molecular formula of the compound?

The molecular formula is C14H13N3O.

What is the molecular weight of the compound?

The molecular weight is 239.27 g/mol.

What is the IUPAC name of the compound?

The IUPAC name is 2-amino-7-phenyl-7,8-dihydro-6H-quinazolin-5-one.

What is the InChI of the compound?

The InChI is InChI=1S/C14H13N3O/c15-14-16-8-11-12(17-14)6-10(7-13(11)18)9-4-2-1-3-5-9/h1-5,8,10H,6-7H2,(H2,15,16,17).

What is the InChIKey of the compound?

The InChIKey is QNFZGNPBBNOUBH-UHFFFAOYSA-N.

What is the canonical SMILES of the compound?

The canonical SMILES is C1C(CC(=O)C2=CN=C(N=C21)N)C3=CC=CC=C3.

What is the CAS number of the compound?

The CAS number is 6075-47-4.

What is the XLogP3-AA value of the compound?

The XLogP3-AA value is 1.4.

How many hydrogen bond donor counts does the compound have?

The compound has 1 hydrogen bond donor count.

How many hydrogen bond acceptor counts does the compound have?

The compound has 4 hydrogen bond acceptor counts.