16-fluoro-15-(2-fluoro-6-hydroxyphenyl)-4,9-dimethyl-12-(2-propan-2-ylphenyl)-5-prop-2-enoyl-2,5,9,12,14-pentazatetracyclo[8.8.0.02,7.013,18]octadeca-1(10),13,15,17-tetraene-8,11-dione;16-fluoro-15-(2-fluoro-6-hydroxyphenyl)-4,9-dimethyl-12-(2-propan-2-ylphenyl)-5-prop-2-enoyl-2,5,9,12,14-pentazatetracyclo[8.8.0.02,7.013,18]octadeca-1(10),13,15,17-tetraen-11-one;16-fluoro-15-(2-fluoro-6-methoxyphenyl)-4-methyl-12-(4-methyl-2-propan-2-yl-3-pyridinyl)-5-prop-2-enoyl-9-oxa-2,5,12,14-tetrazatetracyclo[8.8.0.02,7.013,18]octadeca-1(10),13,15,17-tetraen-11-one;16-fluoro-4-methyl-15-(5-methyl-1H-indazol-4-yl)-12-(2-propan-2-ylphenyl)-5-prop-2-enoyl-9-oxa-2,5,12,14-tetrazatetracyclo[8.8.0.02,7.013,18]octadeca-1(10),13,15,17-tetraen-11-one

C133H130F7N21O14 — CID 167648593

IUPAC16-fluoro-15-(2-fluoro-6-hydroxyphenyl)-4,9-dimethyl-12-(2-propan-2-ylphenyl)-5-prop-2-enoyl-2,5,9,12,14-pentazatetracyclo[8.8.0.02,7.013,18]octadeca-1(10),13,15,17-tetraene-8,11-dione;16-fluoro-15-(2-fluoro-6-hydroxyphenyl)-4,9-dimethyl-12-(2-propan-2-ylphenyl)-5-prop-2-enoyl-2,5,9,12,14-pentazatetracyclo[8.8.0.02,7.013,18]octadeca-1(10),13,15,17-tetraen-11-one;16-fluoro-15-(2-fluoro-6-methoxyphenyl)-4-methyl-12-(4-methyl-2-propan-2-yl-3-pyridinyl)-5-prop-2-enoyl-9-oxa-2,5,12,14-tetrazatetracyclo[8.8.0.02,7.013,18]octadeca-1(10),13,15,17-tetraen-11-one;16-fluoro-4-methyl-15-(5-methyl-1H-indazol-4-yl)-12-(2-propan-2-ylphenyl)-5-prop-2-enoyl-9-oxa-2,5,12,14-tetrazatetracyclo[8.8.0.02,7.013,18]octadeca-1(10),13,15,17-tetraen-11-one
SMILESC=CC(=O)N1CC2C(=O)N(C)c3c(c4cc(F)c(-c5c(O)cccc5F)nc4n(-c4ccccc4C(C)C)c3=O)N2CC1C.C=CC(=O)N1CC2CN(C)c3c(c4cc(F)c(-c5c(O)cccc5F)nc4n(-c4ccccc4C(C)C)c3=O)N2CC1C.C=CC(=O)N1CC2COc3c(c4cc(F)c(-c5c(C)ccc6[nH]ncc56)nc4n(-c4ccccc4C(C)C)c3=O)N2CC1C.C=CC(=O)N1CC2COc3c(c4cc(F)c(-c5c(F)cccc5OC)nc4n(-c4c(C)ccnc4C(C)C)c3=O)N2CC1C
InChIInChI=1S/C34H33FN6O3.C33H33F2N5O4.C33H31F2N5O4.C33H33F2N5O3/c1-6-28(42)39-16-21-17-44-32-31(40(21)15-20(39)5)23-13-25(35)30(29-19(4)11-12-26-24(29)14-36-38-26)37-33(23)41(34(32)43)27-10-8-7-9-22(27)18(2)3;1-7-25(41)38-15-20-16-44-31-30(39(20)14-19(38)5)21-13-23(35)28(26-22(34)9-8-10-24(26)43-6)37-32(21)40(33(31)42)29-18(4)11-12-36-27(29)17(2)3;1-6-26(42)38-16-24-32(43)37(5)30-29(39(24)15-18(38)4)20-14-22(35)28(27-21(34)11-9-13-25(27)41)36-31(20)40(33(30)44)23-12-8-7-10-19(23)17(2)3;1-6-27(42)38-17-20-16-37(5)31-30(39(20)15-19(38)4)22-14-24(35)29(28-23(34)11-9-13-26(28)41)36-32(22)40(33(31)43)25-12-8-7-10-21(25)18(2)3/h6-14,18,20-21H,1,15-17H2,2-5H3,(H,36,38);7-13,17,19-20H,1,14-16H2,2-6H3;6-14,17-18,24,41H,1,15-16H2,2-5H3;6-14,18-20,41H,1,15-17H2,2-5H3
InChIKeyQGACUVDOVLDTNN-UHFFFAOYSA-N
MW2379.62 g/mol
LogP20.56
Rot. Bonds17

About 16-fluoro-15-(2-fluoro-6-hydroxyphenyl)-4,9-dimethyl-12-(2-propan-2-ylphenyl)-5-prop-2-enoyl-2,5,9,12,14-pentazatetracyclo[8.8.0.02,7.013,18]octadeca-1(10),13,15,17-tetraene-8,11-dione;16-fluoro-15-(2-fluoro-6-hydroxyphenyl)-4,9-dimethyl-12-(2-propan-2-ylphenyl)-5-prop-2-enoyl-2,5,9,12,14-pentazatetracyclo[8.8.0.02,7.013,18]octadeca-1(10),13,15,17-tetraen-11-one;16-fluoro-15-(2-fluoro-6-methoxyphenyl)-4-methyl-12-(4-methyl-2-propan-2-yl-3-pyridinyl)-5-prop-2-enoyl-9-oxa-2,5,12,14-tetrazatetracyclo[8.8.0.02,7.013,18]octadeca-1(10),13,15,17-tetraen-11-one;16-fluoro-4-methyl-15-(5-methyl-1H-indazol-4-yl)-12-(2-propan-2-ylphenyl)-5-prop-2-enoyl-9-oxa-2,5,12,14-tetrazatetracyclo[8.8.0.02,7.013,18]octadeca-1(10),13,15,17-tetraen-11-one

16-fluoro-15-(2-fluoro-6-hydroxyphenyl)-4,9-dimethyl-12-(2-propan-2-ylphenyl)-5-prop-2-enoyl-2,5,9,12,14-pentazatetracyclo[8.8.0.02,7.013,18]octadeca-1(10),13,15,17-tetraene-8,11-dione;16-fluoro-15-(2-fluoro-6-hydroxyphenyl)-4,9-dimethyl-12-(2-propan-2-ylphenyl)-5-prop-2-enoyl-2,5,9,12,14-pentazatetracyclo[8.8.0.02,7.013,18]octadeca-1(10),13,15,17-tetraen-11-one;16-fluoro-15-(2-fluoro-6-methoxyphenyl)-4-methyl-12-(4-methyl-2-propan-2-yl-3-pyridinyl)-5-prop-2-enoyl-9-oxa-2,5,12,14-tetrazatetracyclo[8.8.0.02,7.013,18]octadeca-1(10),13,15,17-tetraen-11-one;16-fluoro-4-methyl-15-(5-methyl-1H-indazol-4-yl)-12-(2-propan-2-ylphenyl)-5-prop-2-enoyl-9-oxa-2,5,12,14-tetrazatetracyclo[8.8.0.02,7.013,18]octadeca-1(10),13,15,17-tetraen-11-one (PubChem CID 167648593) has the molecular formula C133H130F7N21O14 and a molecular weight of 2379.62 g/mol. Its IUPAC name is 16-fluoro-15-(2-fluoro-6-hydroxyphenyl)-4,9-dimethyl-12-(2-propan-2-ylphenyl)-5-prop-2-enoyl-2,5,9,12,14-pentazatetracyclo[8.8.0.02,7.013,18]octadeca-1(10),13,15,17-tetraene-8,11-dione;16-fluoro-15-(2-fluoro-6-hydroxyphenyl)-4,9-dimethyl-12-(2-propan-2-ylphenyl)-5-prop-2-enoyl-2,5,9,12,14-pentazatetracyclo[8.8.0.02,7.013,18]octadeca-1(10),13,15,17-tetraen-11-one;16-fluoro-15-(2-fluoro-6-methoxyphenyl)-4-methyl-12-(4-methyl-2-propan-2-yl-3-pyridinyl)-5-prop-2-enoyl-9-oxa-2,5,12,14-tetrazatetracyclo[8.8.0.02,7.013,18]octadeca-1(10),13,15,17-tetraen-11-one;16-fluoro-4-methyl-15-(5-methyl-1H-indazol-4-yl)-12-(2-propan-2-ylphenyl)-5-prop-2-enoyl-9-oxa-2,5,12,14-tetrazatetracyclo[8.8.0.02,7.013,18]octadeca-1(10),13,15,17-tetraen-11-one.

Molecular Properties

Compound Name16-fluoro-15-(2-fluoro-6-hydroxyphenyl)-4,9-dimethyl-12-(2-propan-2-ylphenyl)-5-prop-2-enoyl-2,5,9,12,14-pentazatetracyclo[8.8.0.02,7.013,18]octadeca-1(10),13,15,17-tetraene-8,11-dione;16-fluoro-15-(2-fluoro-6-hydroxyphenyl)-4,9-dimethyl-12-(2-propan-2-ylphenyl)-5-prop-2-enoyl-2,5,9,12,14-pentazatetracyclo[8.8.0.02,7.013,18]octadeca-1(10),13,15,17-tetraen-11-one;16-fluoro-15-(2-fluoro-6-methoxyphenyl)-4-methyl-12-(4-methyl-2-propan-2-yl-3-pyridinyl)-5-prop-2-enoyl-9-oxa-2,5,12,14-tetrazatetracyclo[8.8.0.02,7.013,18]octadeca-1(10),13,15,17-tetraen-11-one;16-fluoro-4-methyl-15-(5-methyl-1H-indazol-4-yl)-12-(2-propan-2-ylphenyl)-5-prop-2-enoyl-9-oxa-2,5,12,14-tetrazatetracyclo[8.8.0.02,7.013,18]octadeca-1(10),13,15,17-tetraen-11-one
PubChem CID167648593
Molecular FormulaC133H130F7N21O14
Molecular Weight2379.62 g/mol
Exact Mass2378.00
IUPAC Name16-fluoro-15-(2-fluoro-6-hydroxyphenyl)-4,9-dimethyl-12-(2-propan-2-ylphenyl)-5-prop-2-enoyl-2,5,9,12,14-pentazatetracyclo[8.8.0.02,7.013,18]octadeca-1(10),13,15,17-tetraene-8,11-dione;16-fluoro-15-(2-fluoro-6-hydroxyphenyl)-4,9-dimethyl-12-(2-propan-2-ylphenyl)-5-prop-2-enoyl-2,5,9,12,14-pentazatetracyclo[8.8.0.02,7.013,18]octadeca-1(10),13,15,17-tetraen-11-one;16-fluoro-15-(2-fluoro-6-methoxyphenyl)-4-methyl-12-(4-methyl-2-propan-2-yl-3-pyridinyl)-5-prop-2-enoyl-9-oxa-2,5,12,14-tetrazatetracyclo[8.8.0.02,7.013,18]octadeca-1(10),13,15,17-tetraen-11-one;16-fluoro-4-methyl-15-(5-methyl-1H-indazol-4-yl)-12-(2-propan-2-ylphenyl)-5-prop-2-enoyl-9-oxa-2,5,12,14-tetrazatetracyclo[8.8.0.02,7.013,18]octadeca-1(10),13,15,17-tetraen-11-one
SMILESC=CC(=O)N1CC2C(=O)N(C)c3c(c4cc(F)c(-c5c(O)cccc5F)nc4n(-c4ccccc4C(C)C)c3=O)N2CC1C.C=CC(=O)N1CC2CN(C)c3c(c4cc(F)c(-c5c(O)cccc5F)nc4n(-c4ccccc4C(C)C)c3=O)N2CC1C.C=CC(=O)N1CC2COc3c(c4cc(F)c(-c5c(C)ccc6[nH]ncc56)nc4n(-c4ccccc4C(C)C)c3=O)N2CC1C.C=CC(=O)N1CC2COc3c(c4cc(F)c(-c5c(F)cccc5OC)nc4n(-c4c(C)ccnc4C(C)C)c3=O)N2CC1C
InChIInChI=1S/C34H33FN6O3.C33H33F2N5O4.C33H31F2N5O4.C33H33F2N5O3/c1-6-28(42)39-16-21-17-44-32-31(40(21)15-20(39)5)23-13-25(35)30(29-19(4)11-12-26-24(29)14-36-38-26)37-33(23)41(34(32)43)27-10-8-7-9-22(27)18(2)3;1-7-25(41)38-15-20-16-44-31-30(39(20)14-19(38)5)21-13-23(35)28(26-22(34)9-8-10-24(26)43-6)37-32(21)40(33(31)42)29-18(4)11-12-36-27(29)17(2)3;1-6-26(42)38-16-24-32(43)37(5)30-29(39(24)15-18(38)4)20-14-22(35)28(27-21(34)11-9-13-25(27)41)36-31(20)40(33(30)44)23-12-8-7-10-19(23)17(2)3;1-6-27(42)38-17-20-16-37(5)31-30(39(20)15-19(38)4)22-14-24(35)29(28-23(34)11-9-13-26(28)41)36-32(22)40(33(31)43)25-12-8-7-10-21(25)18(2)3/h6-14,18,20-21H,1,15-17H2,2-5H3,(H,36,38);7-13,17,19-20H,1,14-16H2,2-6H3;6-14,17-18,24,41H,1,15-16H2,2-5H3;6-14,18-20,41H,1,15-17H2,2-5H3
InChIKeyQGACUVDOVLDTNN-UHFFFAOYSA-N
XLogP20.56
TPSA367.03 Ų
H-Bond Donors3
H-Bond Acceptors29
Rotatable Bonds17
Heavy Atoms175
Complexity

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002379.62
LogP ≤ 520.56
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 1029

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Michael_acceptor_1', 'substructure': 'N/A'}

Analyze 16-fluoro-15-(2-fluoro-6-hydroxyphenyl)-4,9-dimethyl-12-(2-propan-2-ylphenyl)-5-prop-2-enoyl-2,5,9,12,14-pentazatetracyclo[8.8.0.02,7.013,18]octadeca-1(10),13,15,17-tetraene-8,11-dione;16-fluoro-15-(2-fluoro-6-hydroxyphenyl)-4,9-dimethyl-12-(2-propan-2-ylphenyl)-5-prop-2-enoyl-2,5,9,12,14-pentazatetracyclo[8.8.0.02,7.013,18]octadeca-1(10),13,15,17-tetraen-11-one;16-fluoro-15-(2-fluoro-6-methoxyphenyl)-4-methyl-12-(4-methyl-2-propan-2-yl-3-pyridinyl)-5-prop-2-enoyl-9-oxa-2,5,12,14-tetrazatetracyclo[8.8.0.02,7.013,18]octadeca-1(10),13,15,17-tetraen-11-one;16-fluoro-4-methyl-15-(5-methyl-1H-indazol-4-yl)-12-(2-propan-2-ylphenyl)-5-prop-2-enoyl-9-oxa-2,5,12,14-tetrazatetracyclo[8.8.0.02,7.013,18]octadeca-1(10),13,15,17-tetraen-11-one with MolForge

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Frequently Asked Questions

What is the IUPAC name of 16-fluoro-15-(2-fluoro-6-hydroxyphenyl)-4,9-dimethyl-12-(2-propan-2-ylphenyl)-5-prop-2-enoyl-2,5,9,12,14-pentazatetracyclo[8.8.0.02,7.013,18]octadeca-1(10),13,15,17-tetraene-8,11-dione;16-fluoro-15-(2-fluoro-6-hydroxyphenyl)-4,9-dimethyl-12-(2-propan-2-ylphenyl)-5-prop-2-enoyl-2,5,9,12,14-pentazatetracyclo[8.8.0.02,7.013,18]octadeca-1(10),13,15,17-tetraen-11-one;16-fluoro-15-(2-fluoro-6-methoxyphenyl)-4-methyl-12-(4-methyl-2-propan-2-yl-3-pyridinyl)-5-prop-2-enoyl-9-oxa-2,5,12,14-tetrazatetracyclo[8.8.0.02,7.013,18]octadeca-1(10),13,15,17-tetraen-11-one;16-fluoro-4-methyl-15-(5-methyl-1H-indazol-4-yl)-12-(2-propan-2-ylphenyl)-5-prop-2-enoyl-9-oxa-2,5,12,14-tetrazatetracyclo[8.8.0.02,7.013,18]octadeca-1(10),13,15,17-tetraen-11-one?
The IUPAC name of 16-fluoro-15-(2-fluoro-6-hydroxyphenyl)-4,9-dimethyl-12-(2-propan-2-ylphenyl)-5-prop-2-enoyl-2,5,9,12,14-pentazatetracyclo[8.8.0.02,7.013,18]octadeca-1(10),13,15,17-tetraene-8,11-dione;16-fluoro-15-(2-fluoro-6-hydroxyphenyl)-4,9-dimethyl-12-(2-propan-2-ylphenyl)-5-prop-2-enoyl-2,5,9,12,14-pentazatetracyclo[8.8.0.02,7.013,18]octadeca-1(10),13,15,17-tetraen-11-one;16-fluoro-15-(2-fluoro-6-methoxyphenyl)-4-methyl-12-(4-methyl-2-propan-2-yl-3-pyridinyl)-5-prop-2-enoyl-9-oxa-2,5,12,14-tetrazatetracyclo[8.8.0.02,7.013,18]octadeca-1(10),13,15,17-tetraen-11-one;16-fluoro-4-methyl-15-(5-methyl-1H-indazol-4-yl)-12-(2-propan-2-ylphenyl)-5-prop-2-enoyl-9-oxa-2,5,12,14-tetrazatetracyclo[8.8.0.02,7.013,18]octadeca-1(10),13,15,17-tetraen-11-one (CID 167648593) is 16-fluoro-15-(2-fluoro-6-hydroxyphenyl)-4,9-dimethyl-12-(2-propan-2-ylphenyl)-5-prop-2-enoyl-2,5,9,12,14-pentazatetracyclo[8.8.0.02,7.013,18]octadeca-1(10),13,15,17-tetraene-8,11-dione;16-fluoro-15-(2-fluoro-6-hydroxyphenyl)-4,9-dimethyl-12-(2-propan-2-ylphenyl)-5-prop-2-enoyl-2,5,9,12,14-pentazatetracyclo[8.8.0.02,7.013,18]octadeca-1(10),13,15,17-tetraen-11-one;16-fluoro-15-(2-fluoro-6-methoxyphenyl)-4-methyl-12-(4-methyl-2-propan-2-yl-3-pyridinyl)-5-prop-2-enoyl-9-oxa-2,5,12,14-tetrazatetracyclo[8.8.0.02,7.013,18]octadeca-1(10),13,15,17-tetraen-11-one;16-fluoro-4-methyl-15-(5-methyl-1H-indazol-4-yl)-12-(2-propan-2-ylphenyl)-5-prop-2-enoyl-9-oxa-2,5,12,14-tetrazatetracyclo[8.8.0.02,7.013,18]octadeca-1(10),13,15,17-tetraen-11-one.
What is the SMILES notation for 16-fluoro-15-(2-fluoro-6-hydroxyphenyl)-4,9-dimethyl-12-(2-propan-2-ylphenyl)-5-prop-2-enoyl-2,5,9,12,14-pentazatetracyclo[8.8.0.02,7.013,18]octadeca-1(10),13,15,17-tetraene-8,11-dione;16-fluoro-15-(2-fluoro-6-hydroxyphenyl)-4,9-dimethyl-12-(2-propan-2-ylphenyl)-5-prop-2-enoyl-2,5,9,12,14-pentazatetracyclo[8.8.0.02,7.013,18]octadeca-1(10),13,15,17-tetraen-11-one;16-fluoro-15-(2-fluoro-6-methoxyphenyl)-4-methyl-12-(4-methyl-2-propan-2-yl-3-pyridinyl)-5-prop-2-enoyl-9-oxa-2,5,12,14-tetrazatetracyclo[8.8.0.02,7.013,18]octadeca-1(10),13,15,17-tetraen-11-one;16-fluoro-4-methyl-15-(5-methyl-1H-indazol-4-yl)-12-(2-propan-2-ylphenyl)-5-prop-2-enoyl-9-oxa-2,5,12,14-tetrazatetracyclo[8.8.0.02,7.013,18]octadeca-1(10),13,15,17-tetraen-11-one?
The canonical SMILES for 16-fluoro-15-(2-fluoro-6-hydroxyphenyl)-4,9-dimethyl-12-(2-propan-2-ylphenyl)-5-prop-2-enoyl-2,5,9,12,14-pentazatetracyclo[8.8.0.02,7.013,18]octadeca-1(10),13,15,17-tetraene-8,11-dione;16-fluoro-15-(2-fluoro-6-hydroxyphenyl)-4,9-dimethyl-12-(2-propan-2-ylphenyl)-5-prop-2-enoyl-2,5,9,12,14-pentazatetracyclo[8.8.0.02,7.013,18]octadeca-1(10),13,15,17-tetraen-11-one;16-fluoro-15-(2-fluoro-6-methoxyphenyl)-4-methyl-12-(4-methyl-2-propan-2-yl-3-pyridinyl)-5-prop-2-enoyl-9-oxa-2,5,12,14-tetrazatetracyclo[8.8.0.02,7.013,18]octadeca-1(10),13,15,17-tetraen-11-one;16-fluoro-4-methyl-15-(5-methyl-1H-indazol-4-yl)-12-(2-propan-2-ylphenyl)-5-prop-2-enoyl-9-oxa-2,5,12,14-tetrazatetracyclo[8.8.0.02,7.013,18]octadeca-1(10),13,15,17-tetraen-11-one is C=CC(=O)N1CC2C(=O)N(C)c3c(c4cc(F)c(-c5c(O)cccc5F)nc4n(-c4ccccc4C(C)C)c3=O)N2CC1C.C=CC(=O)N1CC2CN(C)c3c(c4cc(F)c(-c5c(O)cccc5F)nc4n(-c4ccccc4C(C)C)c3=O)N2CC1C.C=CC(=O)N1CC2COc3c(c4cc(F)c(-c5c(C)ccc6[nH]ncc56)nc4n(-c4ccccc4C(C)C)c3=O)N2CC1C.C=CC(=O)N1CC2COc3c(c4cc(F)c(-c5c(F)cccc5OC)nc4n(-c4c(C)ccnc4C(C)C)c3=O)N2CC1C.
What is the InChIKey of 16-fluoro-15-(2-fluoro-6-hydroxyphenyl)-4,9-dimethyl-12-(2-propan-2-ylphenyl)-5-prop-2-enoyl-2,5,9,12,14-pentazatetracyclo[8.8.0.02,7.013,18]octadeca-1(10),13,15,17-tetraene-8,11-dione;16-fluoro-15-(2-fluoro-6-hydroxyphenyl)-4,9-dimethyl-12-(2-propan-2-ylphenyl)-5-prop-2-enoyl-2,5,9,12,14-pentazatetracyclo[8.8.0.02,7.013,18]octadeca-1(10),13,15,17-tetraen-11-one;16-fluoro-15-(2-fluoro-6-methoxyphenyl)-4-methyl-12-(4-methyl-2-propan-2-yl-3-pyridinyl)-5-prop-2-enoyl-9-oxa-2,5,12,14-tetrazatetracyclo[8.8.0.02,7.013,18]octadeca-1(10),13,15,17-tetraen-11-one;16-fluoro-4-methyl-15-(5-methyl-1H-indazol-4-yl)-12-(2-propan-2-ylphenyl)-5-prop-2-enoyl-9-oxa-2,5,12,14-tetrazatetracyclo[8.8.0.02,7.013,18]octadeca-1(10),13,15,17-tetraen-11-one?
The InChIKey is QGACUVDOVLDTNN-UHFFFAOYSA-N. The full InChI is InChI=1S/C34H33FN6O3.C33H33F2N5O4.C33H31F2N5O4.C33H33F2N5O3/c1-6-28(42)39-16-21-17-44-32-31(40(21)15-20(39)5)23-13-25(35)30(29-19(4)11-12-26-24(29)14-36-38-26)37-33(23)41(34(32)43)27-10-8-7-9-22(27)18(2)3;1-7-25(41)38-15-20-16-44-31-30(39(20)14-19(38)5)21-13-23(35)28(26-22(34)9-8-10-24(26)43-6)37-32(21)40(33(31)42)29-18(4)11-12-36-27(29)17(2)3;1-6-26(42)38-16-24-32(43)37(5)30-29(39(24)15-18(38)4)20-14-22(35)28(27-21(34)11-9-13-25(27)41)36-31(20)40(33(30)44)23-12-8-7-10-19(23)17(2)3;1-6-27(42)38-17-20-16-37(5)31-30(39(20)15-19(38)4)22-14-24(35)29(28-23(34)11-9-13-26(28)41)36-32(22)40(33(31)43)25-12-8-7-10-21(25)18(2)3/h6-14,18,20-21H,1,15-17H2,2-5H3,(H,36,38);7-13,17,19-20H,1,14-16H2,2-6H3;6-14,17-18,24,41H,1,15-16H2,2-5H3;6-14,18-20,41H,1,15-17H2,2-5H3.
What are the key properties of 16-fluoro-15-(2-fluoro-6-hydroxyphenyl)-4,9-dimethyl-12-(2-propan-2-ylphenyl)-5-prop-2-enoyl-2,5,9,12,14-pentazatetracyclo[8.8.0.02,7.013,18]octadeca-1(10),13,15,17-tetraene-8,11-dione;16-fluoro-15-(2-fluoro-6-hydroxyphenyl)-4,9-dimethyl-12-(2-propan-2-ylphenyl)-5-prop-2-enoyl-2,5,9,12,14-pentazatetracyclo[8.8.0.02,7.013,18]octadeca-1(10),13,15,17-tetraen-11-one;16-fluoro-15-(2-fluoro-6-methoxyphenyl)-4-methyl-12-(4-methyl-2-propan-2-yl-3-pyridinyl)-5-prop-2-enoyl-9-oxa-2,5,12,14-tetrazatetracyclo[8.8.0.02,7.013,18]octadeca-1(10),13,15,17-tetraen-11-one;16-fluoro-4-methyl-15-(5-methyl-1H-indazol-4-yl)-12-(2-propan-2-ylphenyl)-5-prop-2-enoyl-9-oxa-2,5,12,14-tetrazatetracyclo[8.8.0.02,7.013,18]octadeca-1(10),13,15,17-tetraen-11-one?
16-fluoro-15-(2-fluoro-6-hydroxyphenyl)-4,9-dimethyl-12-(2-propan-2-ylphenyl)-5-prop-2-enoyl-2,5,9,12,14-pentazatetracyclo[8.8.0.02,7.013,18]octadeca-1(10),13,15,17-tetraene-8,11-dione;16-fluoro-15-(2-fluoro-6-hydroxyphenyl)-4,9-dimethyl-12-(2-propan-2-ylphenyl)-5-prop-2-enoyl-2,5,9,12,14-pentazatetracyclo[8.8.0.02,7.013,18]octadeca-1(10),13,15,17-tetraen-11-one;16-fluoro-15-(2-fluoro-6-methoxyphenyl)-4-methyl-12-(4-methyl-2-propan-2-yl-3-pyridinyl)-5-prop-2-enoyl-9-oxa-2,5,12,14-tetrazatetracyclo[8.8.0.02,7.013,18]octadeca-1(10),13,15,17-tetraen-11-one;16-fluoro-4-methyl-15-(5-methyl-1H-indazol-4-yl)-12-(2-propan-2-ylphenyl)-5-prop-2-enoyl-9-oxa-2,5,12,14-tetrazatetracyclo[8.8.0.02,7.013,18]octadeca-1(10),13,15,17-tetraen-11-one has a molecular weight of 2379.62 g/mol, XLogP of 20.56, 17 rotatable bonds, 3 hydrogen bond donors, and 29 hydrogen bond acceptors.
Where does this data come from?
All data for 16-fluoro-15-(2-fluoro-6-hydroxyphenyl)-4,9-dimethyl-12-(2-propan-2-ylphenyl)-5-prop-2-enoyl-2,5,9,12,14-pentazatetracyclo[8.8.0.02,7.013,18]octadeca-1(10),13,15,17-tetraene-8,11-dione;16-fluoro-15-(2-fluoro-6-hydroxyphenyl)-4,9-dimethyl-12-(2-propan-2-ylphenyl)-5-prop-2-enoyl-2,5,9,12,14-pentazatetracyclo[8.8.0.02,7.013,18]octadeca-1(10),13,15,17-tetraen-11-one;16-fluoro-15-(2-fluoro-6-methoxyphenyl)-4-methyl-12-(4-methyl-2-propan-2-yl-3-pyridinyl)-5-prop-2-enoyl-9-oxa-2,5,12,14-tetrazatetracyclo[8.8.0.02,7.013,18]octadeca-1(10),13,15,17-tetraen-11-one;16-fluoro-4-methyl-15-(5-methyl-1H-indazol-4-yl)-12-(2-propan-2-ylphenyl)-5-prop-2-enoyl-9-oxa-2,5,12,14-tetrazatetracyclo[8.8.0.02,7.013,18]octadeca-1(10),13,15,17-tetraen-11-one is sourced from PubChem (CID 167648593), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).