6-bromo-2-phenyl-3,10-diazatricyclo[6.4.1.04,13]trideca-1,4,6,8(13)-tetraen-9-one;2-(2-chlorophenyl)-3,10-diazatricyclo[6.4.1.04,13]trideca-1,4,6,8(13)-tetraen-9-one;2-(3-chlorophenyl)-3,10-diazatricyclo[6.4.1.04,13]trideca-1,4,6,8(13)-tetraen-9-one;2-[3-[(dimethylamino)methyl]phenyl]-3,10-diazatricyclo[6.4.1.04,13]trideca-1,4,6,8(13)-tetraen-9-one;2-[4-[(dimethylamino)methyl]phenyl]-3,10-diazatricyclo[6.4.1.04,13]trideca-1,4,6,8(13)-tetraen-9-one;2-(4-methylphenyl)-3,10-diazatricyclo[6.4.1.04,13]trideca-1,4,6,8(13)-tetraen-9-one;2-naphthalen-1-yl-3,10-diazatricyclo[6.4.1.04,13]trideca-1,4,6,8(13)-tetraen-9-one;2-(2-phenylethyl)-3,10-diazatricyclo[6.4.1.04,13]trideca-1,4,6,8(13)-tetraen-9-one

C149H131BrCl2N18O8 — CID 159948784

IUPAC6-bromo-2-phenyl-3,10-diazatricyclo[6.4.1.04,13]trideca-1,4,6,8(13)-tetraen-9-one;2-(2-chlorophenyl)-3,10-diazatricyclo[6.4.1.04,13]trideca-1,4,6,8(13)-tetraen-9-one;2-(3-chlorophenyl)-3,10-diazatricyclo[6.4.1.04,13]trideca-1,4,6,8(13)-tetraen-9-one;2-[3-[(dimethylamino)methyl]phenyl]-3,10-diazatricyclo[6.4.1.04,13]trideca-1,4,6,8(13)-tetraen-9-one;2-[4-[(dimethylamino)methyl]phenyl]-3,10-diazatricyclo[6.4.1.04,13]trideca-1,4,6,8(13)-tetraen-9-one;2-(4-methylphenyl)-3,10-diazatricyclo[6.4.1.04,13]trideca-1,4,6,8(13)-tetraen-9-one;2-naphthalen-1-yl-3,10-diazatricyclo[6.4.1.04,13]trideca-1,4,6,8(13)-tetraen-9-one;2-(2-phenylethyl)-3,10-diazatricyclo[6.4.1.04,13]trideca-1,4,6,8(13)-tetraen-9-one
SMILESCN(C)Cc1ccc(-c2[nH]c3cccc4c3c2CCNC4=O)cc1.CN(C)Cc1cccc(-c2[nH]c3cccc4c3c2CCNC4=O)c1.Cc1ccc(-c2[nH]c3cccc4c3c2CCNC4=O)cc1.O=C1NCCc2c(-c3cccc(Cl)c3)[nH]c3cccc1c23.O=C1NCCc2c(-c3cccc4ccccc34)[nH]c3cccc1c23.O=C1NCCc2c(-c3ccccc3)[nH]c3cc(Br)cc1c23.O=C1NCCc2c(-c3ccccc3Cl)[nH]c3cccc1c23.O=C1NCCc2c(CCc3ccccc3)[nH]c3cccc1c23
InChIInChI=1S/C21H16N2O.2C20H21N3O.C19H18N2O.C18H16N2O.C17H13BrN2O.2C17H13ClN2O/c24-21-17-9-4-10-18-19(17)16(11-12-22-21)20(23-18)15-8-3-6-13-5-1-2-7-14(13)15;1-23(2)12-13-5-3-6-14(11-13)19-15-9-10-21-20(24)16-7-4-8-17(22-19)18(15)16;1-23(2)12-13-6-8-14(9-7-13)19-15-10-11-21-20(24)16-4-3-5-17(22-19)18(15)16;22-19-15-7-4-8-17-18(15)14(11-12-20-19)16(21-17)10-9-13-5-2-1-3-6-13;1-11-5-7-12(8-6-11)17-13-9-10-19-18(21)14-3-2-4-15(20-17)16(13)14;18-11-8-13-15-12(6-7-19-17(13)21)16(20-14(15)9-11)10-4-2-1-3-5-10;18-11-4-1-3-10(9-11)16-12-7-8-19-17(21)13-5-2-6-14(20-16)15(12)13;18-13-6-2-1-4-10(13)16-11-8-9-19-17(21)12-5-3-7-14(20-16)15(11)12/h1-10,23H,11-12H2,(H,22,24);3-8,11,22H,9-10,12H2,1-2H3,(H,21,24);3-9,22H,10-12H2,1-2H3,(H,21,24);1-8,21H,9-12H2,(H,20,22);2-8,20H,9-10H2,1H3,(H,19,21);1-5,8-9,20H,6-7H2,(H,19,21);1-6,9,20H,7-8H2,(H,19,21);1-7,20H,8-9H2,(H,19,21)
InChIKeyOBVHZSZJCZGXFF-UHFFFAOYSA-N
MW2452.61 g/mol
LogP28.74
Rot. Bonds14

About 6-bromo-2-phenyl-3,10-diazatricyclo[6.4.1.04,13]trideca-1,4,6,8(13)-tetraen-9-one;2-(2-chlorophenyl)-3,10-diazatricyclo[6.4.1.04,13]trideca-1,4,6,8(13)-tetraen-9-one;2-(3-chlorophenyl)-3,10-diazatricyclo[6.4.1.04,13]trideca-1,4,6,8(13)-tetraen-9-one;2-[3-[(dimethylamino)methyl]phenyl]-3,10-diazatricyclo[6.4.1.04,13]trideca-1,4,6,8(13)-tetraen-9-one;2-[4-[(dimethylamino)methyl]phenyl]-3,10-diazatricyclo[6.4.1.04,13]trideca-1,4,6,8(13)-tetraen-9-one;2-(4-methylphenyl)-3,10-diazatricyclo[6.4.1.04,13]trideca-1,4,6,8(13)-tetraen-9-one;2-naphthalen-1-yl-3,10-diazatricyclo[6.4.1.04,13]trideca-1,4,6,8(13)-tetraen-9-one;2-(2-phenylethyl)-3,10-diazatricyclo[6.4.1.04,13]trideca-1,4,6,8(13)-tetraen-9-one

6-bromo-2-phenyl-3,10-diazatricyclo[6.4.1.04,13]trideca-1,4,6,8(13)-tetraen-9-one;2-(2-chlorophenyl)-3,10-diazatricyclo[6.4.1.04,13]trideca-1,4,6,8(13)-tetraen-9-one;2-(3-chlorophenyl)-3,10-diazatricyclo[6.4.1.04,13]trideca-1,4,6,8(13)-tetraen-9-one;2-[3-[(dimethylamino)methyl]phenyl]-3,10-diazatricyclo[6.4.1.04,13]trideca-1,4,6,8(13)-tetraen-9-one;2-[4-[(dimethylamino)methyl]phenyl]-3,10-diazatricyclo[6.4.1.04,13]trideca-1,4,6,8(13)-tetraen-9-one;2-(4-methylphenyl)-3,10-diazatricyclo[6.4.1.04,13]trideca-1,4,6,8(13)-tetraen-9-one;2-naphthalen-1-yl-3,10-diazatricyclo[6.4.1.04,13]trideca-1,4,6,8(13)-tetraen-9-one;2-(2-phenylethyl)-3,10-diazatricyclo[6.4.1.04,13]trideca-1,4,6,8(13)-tetraen-9-one (PubChem CID 159948784) has the molecular formula C149H131BrCl2N18O8 and a molecular weight of 2452.61 g/mol. Its IUPAC name is 6-bromo-2-phenyl-3,10-diazatricyclo[6.4.1.04,13]trideca-1,4,6,8(13)-tetraen-9-one;2-(2-chlorophenyl)-3,10-diazatricyclo[6.4.1.04,13]trideca-1,4,6,8(13)-tetraen-9-one;2-(3-chlorophenyl)-3,10-diazatricyclo[6.4.1.04,13]trideca-1,4,6,8(13)-tetraen-9-one;2-[3-[(dimethylamino)methyl]phenyl]-3,10-diazatricyclo[6.4.1.04,13]trideca-1,4,6,8(13)-tetraen-9-one;2-[4-[(dimethylamino)methyl]phenyl]-3,10-diazatricyclo[6.4.1.04,13]trideca-1,4,6,8(13)-tetraen-9-one;2-(4-methylphenyl)-3,10-diazatricyclo[6.4.1.04,13]trideca-1,4,6,8(13)-tetraen-9-one;2-naphthalen-1-yl-3,10-diazatricyclo[6.4.1.04,13]trideca-1,4,6,8(13)-tetraen-9-one;2-(2-phenylethyl)-3,10-diazatricyclo[6.4.1.04,13]trideca-1,4,6,8(13)-tetraen-9-one.

Molecular Properties

Compound Name6-bromo-2-phenyl-3,10-diazatricyclo[6.4.1.04,13]trideca-1,4,6,8(13)-tetraen-9-one;2-(2-chlorophenyl)-3,10-diazatricyclo[6.4.1.04,13]trideca-1,4,6,8(13)-tetraen-9-one;2-(3-chlorophenyl)-3,10-diazatricyclo[6.4.1.04,13]trideca-1,4,6,8(13)-tetraen-9-one;2-[3-[(dimethylamino)methyl]phenyl]-3,10-diazatricyclo[6.4.1.04,13]trideca-1,4,6,8(13)-tetraen-9-one;2-[4-[(dimethylamino)methyl]phenyl]-3,10-diazatricyclo[6.4.1.04,13]trideca-1,4,6,8(13)-tetraen-9-one;2-(4-methylphenyl)-3,10-diazatricyclo[6.4.1.04,13]trideca-1,4,6,8(13)-tetraen-9-one;2-naphthalen-1-yl-3,10-diazatricyclo[6.4.1.04,13]trideca-1,4,6,8(13)-tetraen-9-one;2-(2-phenylethyl)-3,10-diazatricyclo[6.4.1.04,13]trideca-1,4,6,8(13)-tetraen-9-one
PubChem CID159948784
Molecular FormulaC149H131BrCl2N18O8
Molecular Weight2452.61 g/mol
Exact Mass2448.90
IUPAC Name6-bromo-2-phenyl-3,10-diazatricyclo[6.4.1.04,13]trideca-1,4,6,8(13)-tetraen-9-one;2-(2-chlorophenyl)-3,10-diazatricyclo[6.4.1.04,13]trideca-1,4,6,8(13)-tetraen-9-one;2-(3-chlorophenyl)-3,10-diazatricyclo[6.4.1.04,13]trideca-1,4,6,8(13)-tetraen-9-one;2-[3-[(dimethylamino)methyl]phenyl]-3,10-diazatricyclo[6.4.1.04,13]trideca-1,4,6,8(13)-tetraen-9-one;2-[4-[(dimethylamino)methyl]phenyl]-3,10-diazatricyclo[6.4.1.04,13]trideca-1,4,6,8(13)-tetraen-9-one;2-(4-methylphenyl)-3,10-diazatricyclo[6.4.1.04,13]trideca-1,4,6,8(13)-tetraen-9-one;2-naphthalen-1-yl-3,10-diazatricyclo[6.4.1.04,13]trideca-1,4,6,8(13)-tetraen-9-one;2-(2-phenylethyl)-3,10-diazatricyclo[6.4.1.04,13]trideca-1,4,6,8(13)-tetraen-9-one
SMILESCN(C)Cc1ccc(-c2[nH]c3cccc4c3c2CCNC4=O)cc1.CN(C)Cc1cccc(-c2[nH]c3cccc4c3c2CCNC4=O)c1.Cc1ccc(-c2[nH]c3cccc4c3c2CCNC4=O)cc1.O=C1NCCc2c(-c3cccc(Cl)c3)[nH]c3cccc1c23.O=C1NCCc2c(-c3cccc4ccccc34)[nH]c3cccc1c23.O=C1NCCc2c(-c3ccccc3)[nH]c3cc(Br)cc1c23.O=C1NCCc2c(-c3ccccc3Cl)[nH]c3cccc1c23.O=C1NCCc2c(CCc3ccccc3)[nH]c3cccc1c23
InChIInChI=1S/C21H16N2O.2C20H21N3O.C19H18N2O.C18H16N2O.C17H13BrN2O.2C17H13ClN2O/c24-21-17-9-4-10-18-19(17)16(11-12-22-21)20(23-18)15-8-3-6-13-5-1-2-7-14(13)15;1-23(2)12-13-5-3-6-14(11-13)19-15-9-10-21-20(24)16-7-4-8-17(22-19)18(15)16;1-23(2)12-13-6-8-14(9-7-13)19-15-10-11-21-20(24)16-4-3-5-17(22-19)18(15)16;22-19-15-7-4-8-17-18(15)14(11-12-20-19)16(21-17)10-9-13-5-2-1-3-6-13;1-11-5-7-12(8-6-11)17-13-9-10-19-18(21)14-3-2-4-15(20-17)16(13)14;18-11-8-13-15-12(6-7-19-17(13)21)16(20-14(15)9-11)10-4-2-1-3-5-10;18-11-4-1-3-10(9-11)16-12-7-8-19-17(21)13-5-2-6-14(20-16)15(12)13;18-13-6-2-1-4-10(13)16-11-8-9-19-17(21)12-5-3-7-14(20-16)15(11)12/h1-10,23H,11-12H2,(H,22,24);3-8,11,22H,9-10,12H2,1-2H3,(H,21,24);3-9,22H,10-12H2,1-2H3,(H,21,24);1-8,21H,9-12H2,(H,20,22);2-8,20H,9-10H2,1H3,(H,19,21);1-5,8-9,20H,6-7H2,(H,19,21);1-6,9,20H,7-8H2,(H,19,21);1-7,20H,8-9H2,(H,19,21)
InChIKeyOBVHZSZJCZGXFF-UHFFFAOYSA-N
XLogP28.74
TPSA365.60 Ų
H-Bond Donors16
H-Bond Acceptors10
Rotatable Bonds14
Heavy Atoms178
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002452.61
LogP ≤ 528.74
H-Bond Donors ≤ 516
H-Bond Acceptors ≤ 1010

Analyze 6-bromo-2-phenyl-3,10-diazatricyclo[6.4.1.04,13]trideca-1,4,6,8(13)-tetraen-9-one;2-(2-chlorophenyl)-3,10-diazatricyclo[6.4.1.04,13]trideca-1,4,6,8(13)-tetraen-9-one;2-(3-chlorophenyl)-3,10-diazatricyclo[6.4.1.04,13]trideca-1,4,6,8(13)-tetraen-9-one;2-[3-[(dimethylamino)methyl]phenyl]-3,10-diazatricyclo[6.4.1.04,13]trideca-1,4,6,8(13)-tetraen-9-one;2-[4-[(dimethylamino)methyl]phenyl]-3,10-diazatricyclo[6.4.1.04,13]trideca-1,4,6,8(13)-tetraen-9-one;2-(4-methylphenyl)-3,10-diazatricyclo[6.4.1.04,13]trideca-1,4,6,8(13)-tetraen-9-one;2-naphthalen-1-yl-3,10-diazatricyclo[6.4.1.04,13]trideca-1,4,6,8(13)-tetraen-9-one;2-(2-phenylethyl)-3,10-diazatricyclo[6.4.1.04,13]trideca-1,4,6,8(13)-tetraen-9-one with MolForge

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Frequently Asked Questions

What is the IUPAC name of 6-bromo-2-phenyl-3,10-diazatricyclo[6.4.1.04,13]trideca-1,4,6,8(13)-tetraen-9-one;2-(2-chlorophenyl)-3,10-diazatricyclo[6.4.1.04,13]trideca-1,4,6,8(13)-tetraen-9-one;2-(3-chlorophenyl)-3,10-diazatricyclo[6.4.1.04,13]trideca-1,4,6,8(13)-tetraen-9-one;2-[3-[(dimethylamino)methyl]phenyl]-3,10-diazatricyclo[6.4.1.04,13]trideca-1,4,6,8(13)-tetraen-9-one;2-[4-[(dimethylamino)methyl]phenyl]-3,10-diazatricyclo[6.4.1.04,13]trideca-1,4,6,8(13)-tetraen-9-one;2-(4-methylphenyl)-3,10-diazatricyclo[6.4.1.04,13]trideca-1,4,6,8(13)-tetraen-9-one;2-naphthalen-1-yl-3,10-diazatricyclo[6.4.1.04,13]trideca-1,4,6,8(13)-tetraen-9-one;2-(2-phenylethyl)-3,10-diazatricyclo[6.4.1.04,13]trideca-1,4,6,8(13)-tetraen-9-one?
The IUPAC name of 6-bromo-2-phenyl-3,10-diazatricyclo[6.4.1.04,13]trideca-1,4,6,8(13)-tetraen-9-one;2-(2-chlorophenyl)-3,10-diazatricyclo[6.4.1.04,13]trideca-1,4,6,8(13)-tetraen-9-one;2-(3-chlorophenyl)-3,10-diazatricyclo[6.4.1.04,13]trideca-1,4,6,8(13)-tetraen-9-one;2-[3-[(dimethylamino)methyl]phenyl]-3,10-diazatricyclo[6.4.1.04,13]trideca-1,4,6,8(13)-tetraen-9-one;2-[4-[(dimethylamino)methyl]phenyl]-3,10-diazatricyclo[6.4.1.04,13]trideca-1,4,6,8(13)-tetraen-9-one;2-(4-methylphenyl)-3,10-diazatricyclo[6.4.1.04,13]trideca-1,4,6,8(13)-tetraen-9-one;2-naphthalen-1-yl-3,10-diazatricyclo[6.4.1.04,13]trideca-1,4,6,8(13)-tetraen-9-one;2-(2-phenylethyl)-3,10-diazatricyclo[6.4.1.04,13]trideca-1,4,6,8(13)-tetraen-9-one (CID 159948784) is 6-bromo-2-phenyl-3,10-diazatricyclo[6.4.1.04,13]trideca-1,4,6,8(13)-tetraen-9-one;2-(2-chlorophenyl)-3,10-diazatricyclo[6.4.1.04,13]trideca-1,4,6,8(13)-tetraen-9-one;2-(3-chlorophenyl)-3,10-diazatricyclo[6.4.1.04,13]trideca-1,4,6,8(13)-tetraen-9-one;2-[3-[(dimethylamino)methyl]phenyl]-3,10-diazatricyclo[6.4.1.04,13]trideca-1,4,6,8(13)-tetraen-9-one;2-[4-[(dimethylamino)methyl]phenyl]-3,10-diazatricyclo[6.4.1.04,13]trideca-1,4,6,8(13)-tetraen-9-one;2-(4-methylphenyl)-3,10-diazatricyclo[6.4.1.04,13]trideca-1,4,6,8(13)-tetraen-9-one;2-naphthalen-1-yl-3,10-diazatricyclo[6.4.1.04,13]trideca-1,4,6,8(13)-tetraen-9-one;2-(2-phenylethyl)-3,10-diazatricyclo[6.4.1.04,13]trideca-1,4,6,8(13)-tetraen-9-one.
What is the SMILES notation for 6-bromo-2-phenyl-3,10-diazatricyclo[6.4.1.04,13]trideca-1,4,6,8(13)-tetraen-9-one;2-(2-chlorophenyl)-3,10-diazatricyclo[6.4.1.04,13]trideca-1,4,6,8(13)-tetraen-9-one;2-(3-chlorophenyl)-3,10-diazatricyclo[6.4.1.04,13]trideca-1,4,6,8(13)-tetraen-9-one;2-[3-[(dimethylamino)methyl]phenyl]-3,10-diazatricyclo[6.4.1.04,13]trideca-1,4,6,8(13)-tetraen-9-one;2-[4-[(dimethylamino)methyl]phenyl]-3,10-diazatricyclo[6.4.1.04,13]trideca-1,4,6,8(13)-tetraen-9-one;2-(4-methylphenyl)-3,10-diazatricyclo[6.4.1.04,13]trideca-1,4,6,8(13)-tetraen-9-one;2-naphthalen-1-yl-3,10-diazatricyclo[6.4.1.04,13]trideca-1,4,6,8(13)-tetraen-9-one;2-(2-phenylethyl)-3,10-diazatricyclo[6.4.1.04,13]trideca-1,4,6,8(13)-tetraen-9-one?
The canonical SMILES for 6-bromo-2-phenyl-3,10-diazatricyclo[6.4.1.04,13]trideca-1,4,6,8(13)-tetraen-9-one;2-(2-chlorophenyl)-3,10-diazatricyclo[6.4.1.04,13]trideca-1,4,6,8(13)-tetraen-9-one;2-(3-chlorophenyl)-3,10-diazatricyclo[6.4.1.04,13]trideca-1,4,6,8(13)-tetraen-9-one;2-[3-[(dimethylamino)methyl]phenyl]-3,10-diazatricyclo[6.4.1.04,13]trideca-1,4,6,8(13)-tetraen-9-one;2-[4-[(dimethylamino)methyl]phenyl]-3,10-diazatricyclo[6.4.1.04,13]trideca-1,4,6,8(13)-tetraen-9-one;2-(4-methylphenyl)-3,10-diazatricyclo[6.4.1.04,13]trideca-1,4,6,8(13)-tetraen-9-one;2-naphthalen-1-yl-3,10-diazatricyclo[6.4.1.04,13]trideca-1,4,6,8(13)-tetraen-9-one;2-(2-phenylethyl)-3,10-diazatricyclo[6.4.1.04,13]trideca-1,4,6,8(13)-tetraen-9-one is CN(C)Cc1ccc(-c2[nH]c3cccc4c3c2CCNC4=O)cc1.CN(C)Cc1cccc(-c2[nH]c3cccc4c3c2CCNC4=O)c1.Cc1ccc(-c2[nH]c3cccc4c3c2CCNC4=O)cc1.O=C1NCCc2c(-c3cccc(Cl)c3)[nH]c3cccc1c23.O=C1NCCc2c(-c3cccc4ccccc34)[nH]c3cccc1c23.O=C1NCCc2c(-c3ccccc3)[nH]c3cc(Br)cc1c23.O=C1NCCc2c(-c3ccccc3Cl)[nH]c3cccc1c23.O=C1NCCc2c(CCc3ccccc3)[nH]c3cccc1c23.
What is the InChIKey of 6-bromo-2-phenyl-3,10-diazatricyclo[6.4.1.04,13]trideca-1,4,6,8(13)-tetraen-9-one;2-(2-chlorophenyl)-3,10-diazatricyclo[6.4.1.04,13]trideca-1,4,6,8(13)-tetraen-9-one;2-(3-chlorophenyl)-3,10-diazatricyclo[6.4.1.04,13]trideca-1,4,6,8(13)-tetraen-9-one;2-[3-[(dimethylamino)methyl]phenyl]-3,10-diazatricyclo[6.4.1.04,13]trideca-1,4,6,8(13)-tetraen-9-one;2-[4-[(dimethylamino)methyl]phenyl]-3,10-diazatricyclo[6.4.1.04,13]trideca-1,4,6,8(13)-tetraen-9-one;2-(4-methylphenyl)-3,10-diazatricyclo[6.4.1.04,13]trideca-1,4,6,8(13)-tetraen-9-one;2-naphthalen-1-yl-3,10-diazatricyclo[6.4.1.04,13]trideca-1,4,6,8(13)-tetraen-9-one;2-(2-phenylethyl)-3,10-diazatricyclo[6.4.1.04,13]trideca-1,4,6,8(13)-tetraen-9-one?
The InChIKey is OBVHZSZJCZGXFF-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H16N2O.2C20H21N3O.C19H18N2O.C18H16N2O.C17H13BrN2O.2C17H13ClN2O/c24-21-17-9-4-10-18-19(17)16(11-12-22-21)20(23-18)15-8-3-6-13-5-1-2-7-14(13)15;1-23(2)12-13-5-3-6-14(11-13)19-15-9-10-21-20(24)16-7-4-8-17(22-19)18(15)16;1-23(2)12-13-6-8-14(9-7-13)19-15-10-11-21-20(24)16-4-3-5-17(22-19)18(15)16;22-19-15-7-4-8-17-18(15)14(11-12-20-19)16(21-17)10-9-13-5-2-1-3-6-13;1-11-5-7-12(8-6-11)17-13-9-10-19-18(21)14-3-2-4-15(20-17)16(13)14;18-11-8-13-15-12(6-7-19-17(13)21)16(20-14(15)9-11)10-4-2-1-3-5-10;18-11-4-1-3-10(9-11)16-12-7-8-19-17(21)13-5-2-6-14(20-16)15(12)13;18-13-6-2-1-4-10(13)16-11-8-9-19-17(21)12-5-3-7-14(20-16)15(11)12/h1-10,23H,11-12H2,(H,22,24);3-8,11,22H,9-10,12H2,1-2H3,(H,21,24);3-9,22H,10-12H2,1-2H3,(H,21,24);1-8,21H,9-12H2,(H,20,22);2-8,20H,9-10H2,1H3,(H,19,21);1-5,8-9,20H,6-7H2,(H,19,21);1-6,9,20H,7-8H2,(H,19,21);1-7,20H,8-9H2,(H,19,21).
What are the key properties of 6-bromo-2-phenyl-3,10-diazatricyclo[6.4.1.04,13]trideca-1,4,6,8(13)-tetraen-9-one;2-(2-chlorophenyl)-3,10-diazatricyclo[6.4.1.04,13]trideca-1,4,6,8(13)-tetraen-9-one;2-(3-chlorophenyl)-3,10-diazatricyclo[6.4.1.04,13]trideca-1,4,6,8(13)-tetraen-9-one;2-[3-[(dimethylamino)methyl]phenyl]-3,10-diazatricyclo[6.4.1.04,13]trideca-1,4,6,8(13)-tetraen-9-one;2-[4-[(dimethylamino)methyl]phenyl]-3,10-diazatricyclo[6.4.1.04,13]trideca-1,4,6,8(13)-tetraen-9-one;2-(4-methylphenyl)-3,10-diazatricyclo[6.4.1.04,13]trideca-1,4,6,8(13)-tetraen-9-one;2-naphthalen-1-yl-3,10-diazatricyclo[6.4.1.04,13]trideca-1,4,6,8(13)-tetraen-9-one;2-(2-phenylethyl)-3,10-diazatricyclo[6.4.1.04,13]trideca-1,4,6,8(13)-tetraen-9-one?
6-bromo-2-phenyl-3,10-diazatricyclo[6.4.1.04,13]trideca-1,4,6,8(13)-tetraen-9-one;2-(2-chlorophenyl)-3,10-diazatricyclo[6.4.1.04,13]trideca-1,4,6,8(13)-tetraen-9-one;2-(3-chlorophenyl)-3,10-diazatricyclo[6.4.1.04,13]trideca-1,4,6,8(13)-tetraen-9-one;2-[3-[(dimethylamino)methyl]phenyl]-3,10-diazatricyclo[6.4.1.04,13]trideca-1,4,6,8(13)-tetraen-9-one;2-[4-[(dimethylamino)methyl]phenyl]-3,10-diazatricyclo[6.4.1.04,13]trideca-1,4,6,8(13)-tetraen-9-one;2-(4-methylphenyl)-3,10-diazatricyclo[6.4.1.04,13]trideca-1,4,6,8(13)-tetraen-9-one;2-naphthalen-1-yl-3,10-diazatricyclo[6.4.1.04,13]trideca-1,4,6,8(13)-tetraen-9-one;2-(2-phenylethyl)-3,10-diazatricyclo[6.4.1.04,13]trideca-1,4,6,8(13)-tetraen-9-one has a molecular weight of 2452.61 g/mol, XLogP of 28.74, 14 rotatable bonds, 16 hydrogen bond donors, and 10 hydrogen bond acceptors.
Where does this data come from?
All data for 6-bromo-2-phenyl-3,10-diazatricyclo[6.4.1.04,13]trideca-1,4,6,8(13)-tetraen-9-one;2-(2-chlorophenyl)-3,10-diazatricyclo[6.4.1.04,13]trideca-1,4,6,8(13)-tetraen-9-one;2-(3-chlorophenyl)-3,10-diazatricyclo[6.4.1.04,13]trideca-1,4,6,8(13)-tetraen-9-one;2-[3-[(dimethylamino)methyl]phenyl]-3,10-diazatricyclo[6.4.1.04,13]trideca-1,4,6,8(13)-tetraen-9-one;2-[4-[(dimethylamino)methyl]phenyl]-3,10-diazatricyclo[6.4.1.04,13]trideca-1,4,6,8(13)-tetraen-9-one;2-(4-methylphenyl)-3,10-diazatricyclo[6.4.1.04,13]trideca-1,4,6,8(13)-tetraen-9-one;2-naphthalen-1-yl-3,10-diazatricyclo[6.4.1.04,13]trideca-1,4,6,8(13)-tetraen-9-one;2-(2-phenylethyl)-3,10-diazatricyclo[6.4.1.04,13]trideca-1,4,6,8(13)-tetraen-9-one is sourced from PubChem (CID 159948784), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).