4,6-dichloro-8-oxa-10-azatetracyclo[8.7.0.0²,?.0¹²,¹?]heptadeca-2,4,6,12(17),13,15-hexaen-11-one

4,6-dichloro-8-oxa-10-azatetracyclo[8.7.0.0²,?.0¹²,¹?]heptadeca-2,4,6,12(17),13,15-hexaen-11-one

CAS: 866010-42-6

Formula: C15H9Cl2NO2

SMILES: ClC1=CC(Cl)=C2OCN3C(C4=C(C=CC=C4)C3=O)C2=C1

IUPAC: 4,6-dichloro-8-oxa-10-azatetracyclo[8.7.0.0²,?.0¹²,¹?]heptadeca-2,4,6,12(17),13,15-hexaen-11-one

InChI: InChI=1/C15H9Cl2NO2/c16-8-5-11-13-9-3-1-2-4-10(9)15(19)18(13)7-20-14(11)12(17)6-8/h1-6,13H,7H2

Composition: C (58.85%), H (2.96%), Cl (23.16%), N (4.58%), O (10.45%)

Molar Mass: 306.14

Atom Count: 29

Heavy Atom Count: 20

Properties

Properties

Common Names	N/A
Aromatic Ring Count	2
Asymmetric Atom Count	1
Exact Mass	305.0010339
Formal Charge	0
FSP3	0.13
Hetero Ring Count	2
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	0
InChIKey	YYZAFCCJZYEKGT-UHFFFAOYNA-N
Lipinski's Rule of Five	1
Molar Refractivity	76.68
Topological Polar Surface Area	29.54
Polarizability	29.45
Ring Count	4
Rotatable Bond Count	0

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