8-methoxy-2-N,4-N-dimethyl-2-N,4-N-diphenylquinazoline-2,4-diamine

C23H22N4O — CID 10339142

IUPAC8-methoxy-2-N,4-N-dimethyl-2-N,4-N-diphenylquinazoline-2,4-diamine
SMILESCOc1cccc2c(N(C)c3ccccc3)nc(N(C)c3ccccc3)nc12
InChIInChI=1S/C23H22N4O/c1-26(17-11-6-4-7-12-17)22-19-15-10-16-20(28-3)21(19)24-23(25-22)27(2)18-13-8-5-9-14-18/h4-16H,1-3H3
InChIKeyKASCIINVXOKSMA-UHFFFAOYSA-N
MW370.46 g/mol
LogP5.17
Rot. Bonds5

About 8-methoxy-2-N,4-N-dimethyl-2-N,4-N-diphenylquinazoline-2,4-diamine

8-methoxy-2-N,4-N-dimethyl-2-N,4-N-diphenylquinazoline-2,4-diamine (PubChem CID 10339142) has the molecular formula C23H22N4O and a molecular weight of 370.46 g/mol. Its IUPAC name is 8-methoxy-2-N,4-N-dimethyl-2-N,4-N-diphenylquinazoline-2,4-diamine.

Molecular Properties

Compound Name8-methoxy-2-N,4-N-dimethyl-2-N,4-N-diphenylquinazoline-2,4-diamine
PubChem CID10339142
Molecular FormulaC23H22N4O
Molecular Weight370.46 g/mol
Exact Mass370.18
IUPAC Name8-methoxy-2-N,4-N-dimethyl-2-N,4-N-diphenylquinazoline-2,4-diamine
SMILESCOc1cccc2c(N(C)c3ccccc3)nc(N(C)c3ccccc3)nc12
InChIInChI=1S/C23H22N4O/c1-26(17-11-6-4-7-12-17)22-19-15-10-16-20(28-3)21(19)24-23(25-22)27(2)18-13-8-5-9-14-18/h4-16H,1-3H3
InChIKeyKASCIINVXOKSMA-UHFFFAOYSA-N
XLogP5.17
TPSA41.49 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms28
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500370.46
LogP ≤ 55.17
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Analyze 8-methoxy-2-N,4-N-dimethyl-2-N,4-N-diphenylquinazoline-2,4-diamine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 8-methoxy-2-N,4-N-dimethyl-2-N,4-N-diphenylquinazoline-2,4-diamine?
The IUPAC name of 8-methoxy-2-N,4-N-dimethyl-2-N,4-N-diphenylquinazoline-2,4-diamine (CID 10339142) is 8-methoxy-2-N,4-N-dimethyl-2-N,4-N-diphenylquinazoline-2,4-diamine.
What is the SMILES notation for 8-methoxy-2-N,4-N-dimethyl-2-N,4-N-diphenylquinazoline-2,4-diamine?
The canonical SMILES for 8-methoxy-2-N,4-N-dimethyl-2-N,4-N-diphenylquinazoline-2,4-diamine is COc1cccc2c(N(C)c3ccccc3)nc(N(C)c3ccccc3)nc12.
What is the InChIKey of 8-methoxy-2-N,4-N-dimethyl-2-N,4-N-diphenylquinazoline-2,4-diamine?
The InChIKey is KASCIINVXOKSMA-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H22N4O/c1-26(17-11-6-4-7-12-17)22-19-15-10-16-20(28-3)21(19)24-23(25-22)27(2)18-13-8-5-9-14-18/h4-16H,1-3H3.
What are the key properties of 8-methoxy-2-N,4-N-dimethyl-2-N,4-N-diphenylquinazoline-2,4-diamine?
8-methoxy-2-N,4-N-dimethyl-2-N,4-N-diphenylquinazoline-2,4-diamine has a molecular weight of 370.46 g/mol, XLogP of 5.17, 5 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 8-methoxy-2-N,4-N-dimethyl-2-N,4-N-diphenylquinazoline-2,4-diamine is sourced from PubChem (CID 10339142), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).