Text Search
Structure Search

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

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

Formula: C30H30N2O3

SMILES: COC1=CC=CC(=C1)C1N(C(=O)CC2=CC=CC=C2)C2=C(NC3=C1C(=O)CC(C)(C)C3)C=CC=C2

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

InChI: InChI=1/C30H30N2O3/c1-30(2)18-24-28(26(33)19-30)29(21-12-9-13-22(17-21)35-3)32(25-15-8-7-14-23(25)31-24)27(34)16-20-10-5-4-6-11-20/h4-15,17,29,31H,16,18-19H2,1-3H3

Composition: C (77.23%), H (6.48%), N (6.00%), O (10.29%)

Molar Mass: 466.581

Atom Count: 65

Heavy Atom Count: 35

Properties
Properties
Common Names N/A
Aromatic Ring Count 3
Asymmetric Atom Count 1
Exact Mass 466.225642834
Formal Charge 0
FSP3 0.27
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 4
Hydrogen Bond Donor Count 1
InChIKey OGGULRBMDLMXKJ-UHFFFAOYNA-N
Lipinski's Rule of Five 1
Molar Refractivity 139.72
Topological Polar Surface Area 58.64
Polarizability 53.01
Ring Count 5
Rotatable Bond Count 4

Suppliers

Purity (%)
-
Ships Within
Days
Packet Size
| Clear Filters
Molecule Market Select
Purity LeadTime Formula PacketSize UnitPrice
90% <16 Days C30H30N2O3 $33.80-$156.00$33.80$52.00$67.60$93.60$156.00
Request Quote