Text Search
Structure Search

9-acetyl-10-(2-chlorophenyl)-14,14-dimethyl-2,9-diazatricyclo[9.4.0.0³,?]pentadeca-1(11),3(8),4,6-tetraen-12-one

9-acetyl-10-(2-chlorophenyl)-14,14-dimethyl-2,9-diazatricyclo[9.4.0.0³,?]pentadeca-1(11),3(8),4,6-tetraen-12-one

Formula: C23H23ClN2O2

SMILES: CC(=O)N1C(C2=CC=CC=C2Cl)C2=C(CC(C)(C)CC2=O)NC2=C1C=CC=C2

IUPAC: 9-acetyl-10-(2-chlorophenyl)-14,14-dimethyl-2,9-diazatricyclo[9.4.0.0³,?]pentadeca-1(11),3(8),4,6-tetraen-12-one

InChI: InChI=1/C23H23ClN2O2/c1-14(27)26-19-11-7-6-10-17(19)25-18-12-23(2,3)13-20(28)21(18)22(26)15-8-4-5-9-16(15)24/h4-11,22,25H,12-13H2,1-3H3

Composition: C (69.96%), H (5.87%), Cl (8.98%), N (7.09%), O (8.10%)

Molar Mass: 394.9

Atom Count: 51

Heavy Atom Count: 28

Properties
Properties
Common Names N/A
Aromatic Ring Count 2
Asymmetric Atom Count 1
Exact Mass 394.1448057
Formal Charge 0
FSP3 0.3
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 3
Hydrogen Bond Donor Count 1
InChIKey WDIKJYHNOQCKEE-UHFFFAOYNA-N
Lipinski's Rule of Five 1
Molar Refractivity 113.34
Topological Polar Surface Area 49.41
Polarizability 42.75
Ring Count 4
Rotatable Bond Count 1

Suppliers

Purity (%)
-
Ships Within
Days
Packet Size
| Clear Filters
Molecule Market Select
Purity LeadTime Formula PacketSize UnitPrice
90% <16 Days C23H23ClN2O2 $33.80-$156.00$33.80$52.00$67.60$93.60$156.00
Request Quote