[Synonyms]
[Structure]
![N-[3-[(3-chlorophenyl)methyl]-2-methyl-4-oxoquinazolin-6-yl]benzamide](/file/upload/dataimg/118/1174057.png)
[ Properties Computed from Structure]
[ Descriptors Computed from Structure]
IUPAC Name: N-[3-[(3-chlorophenyl)methyl]-2-methyl-4-oxoquinazolin-6-yl]benzamide
Canonical SMILES: CC1=NC2=C(C=C(C=C2)NC(=O)C3=CC=CC=C3)C(=O)N1CC4=CC(=CC=C4)Cl
InChI: InChI=1/C23H18ClN3O2/c1-15-25-21-11-10-19(26-22(28)17-7-3-2-4-8-17)13-20
(21)23(29)27(15)14-16-6-5-9-18(24)12-16/h2-13H,14H2,1H3,(H,26,28)/f/h26H
[Structure]
[ Properties Computed from Structure]
| Molecular Weight | 403.86092 [g/mol] |
| Molecular Formula | C23H18ClN3O2 |
| XLogP | 4.4 |
| H-Bond Donor | 1 |
| H-Bond Acceptor | 3 |
| Rotatable Bond Count | 4 |
| Tautomer Count | 2 |
| Exact Mass | 403.108755 |
| MonoIsotopic Mass | 403.108755 |
| Topological Polar Surface Area | 61.8 |
| Heavy Atom Count | 29 |
| Formal Charge | 0 |
| Complexity | 646 |
| Isotope Atom Count | 0 |
| Defined Atom StereoCenter Count | 0 |
| Undefined Atom StereoCenter Count | 0 |
| Defined Bond StereoCenter Count | 0 |
| Undefined Bond StereoCenter Count | 0 |
| Covalently-Bonded Unit Count | 1 |
[ Descriptors Computed from Structure]
IUPAC Name: N-[3-[(3-chlorophenyl)methyl]-2-methyl-4-oxoquinazolin-6-yl]benzamide
Canonical SMILES: CC1=NC2=C(C=C(C=C2)NC(=O)C3=CC=CC=C3)C(=O)N1CC4=CC(=CC=C4)Cl
InChI: InChI=1/C23H18ClN3O2/c1-15-25-21-11-10-19(26-22(28)17-7-3-2-4-8-17)13-20
(21)23(29)27(15)14-16-6-5-9-18(24)12-16/h2-13H,14H2,1H3,(H,26,28)/f/h26H
