5-(1,3-benzothiazol-2-yl)-10,10,16,16-tetramethyl-3-oxa-13-azatetracyclo[7.7.1.02,7.013,17]heptadeca-1,5,7,9(17)-tetraen-4-one;3-[7-[bis(2-butoxyethyl)amino]-2-oxochromene-3-carbonyl]-7-methylchromen-2-one;3-[7-(dibutylamino)-2-oxochromene-3-carbonyl]-7-methylchromen-2-one;3-[7-(diethylamino)-2-oxochromene-3-carbonyl]-7-methylchromen-2-one;5-[(E)-3-[4-(dimethylamino)phenyl]prop-2-enoyl]-10,10,16,16-tetramethyl-3-oxa-13-azatetracyclo[7.7.1.02,7.013,17]heptadeca-1,5,7,9(17)-tetraen-4-one;3-(3H-indol-2-yl)-7-methylchromen-2-one;5-(3H-indol-2-yl)-10,10,16,16-tetramethyl-3-oxa-13-azatetracyclo[7.7.1.02,7.013,17]heptadeca-1,5,7,9(17)-tetraen-4-one

C185H188N10O26S — CID 158108354

IUPAC5-(1,3-benzothiazol-2-yl)-10,10,16,16-tetramethyl-3-oxa-13-azatetracyclo[7.7.1.02,7.013,17]heptadeca-1,5,7,9(17)-tetraen-4-one;3-[7-[bis(2-butoxyethyl)amino]-2-oxochromene-3-carbonyl]-7-methylchromen-2-one;3-[7-(dibutylamino)-2-oxochromene-3-carbonyl]-7-methylchromen-2-one;3-[7-(diethylamino)-2-oxochromene-3-carbonyl]-7-methylchromen-2-one;5-[(E)-3-[4-(dimethylamino)phenyl]prop-2-enoyl]-10,10,16,16-tetramethyl-3-oxa-13-azatetracyclo[7.7.1.02,7.013,17]heptadeca-1,5,7,9(17)-tetraen-4-one;3-(3H-indol-2-yl)-7-methylchromen-2-one;5-(3H-indol-2-yl)-10,10,16,16-tetramethyl-3-oxa-13-azatetracyclo[7.7.1.02,7.013,17]heptadeca-1,5,7,9(17)-tetraen-4-one
SMILESCC1(C)CCN2CCC(C)(C)c3c2c1cc1cc(-c2nc4ccccc4s2)c(=O)oc31.CC1(C)CCN2CCC(C)(C)c3c2c1cc1cc(C2=Nc4ccccc4C2)c(=O)oc31.CCCCN(CCCC)c1ccc2cc(C(=O)c3cc4ccc(C)cc4oc3=O)c(=O)oc2c1.CCCCOCCN(CCOCCCC)c1ccc2cc(C(=O)c3cc4ccc(C)cc4oc3=O)c(=O)oc2c1.CCN(CC)c1ccc2cc(C(=O)c3cc4ccc(C)cc4oc3=O)c(=O)oc2c1.CN(C)c1ccc(/C=C/C(=O)c2cc3cc4c5c(c3oc2=O)C(C)(C)CCN5CCC4(C)C)cc1.Cc1ccc2cc(C3=Nc4ccccc4C3)c(=O)oc2c1
InChIInChI=1S/C32H37NO7.C30H34N2O3.C28H29NO5.C27H28N2O2.C26H26N2O2S.C24H21NO5.C18H13NO2/c1-4-6-14-37-16-12-33(13-17-38-15-7-5-2)25-11-10-24-20-27(32(36)40-29(24)21-25)30(34)26-19-23-9-8-22(3)18-28(23)39-31(26)35;1-29(2)13-15-32-16-14-30(3,4)25-26(32)23(29)18-20-17-22(28(34)35-27(20)25)24(33)12-9-19-7-10-21(11-8-19)31(5)6;1-4-6-12-29(13-7-5-2)21-11-10-20-16-23(28(32)34-25(20)17-21)26(30)22-15-19-9-8-18(3)14-24(19)33-27(22)31;1-26(2)9-11-29-12-10-27(3,4)22-23(29)19(26)14-17-13-18(25(30)31-24(17)22)21-15-16-7-5-6-8-20(16)28-21;1-25(2)9-11-28-12-10-26(3,4)20-21(28)17(25)14-15-13-16(24(29)30-22(15)20)23-27-18-7-5-6-8-19(18)31-23;1-4-25(5-2)17-9-8-16-12-19(24(28)30-21(16)13-17)22(26)18-11-15-7-6-14(3)10-20(15)29-23(18)27;1-11-6-7-13-9-14(18(20)21-17(13)8-11)16-10-12-4-2-3-5-15(12)19-16/h8-11,18-21H,4-7,12-17H2,1-3H3;7-12,17-18H,13-16H2,1-6H3;8-11,14-17H,4-7,12-13H2,1-3H3;5-8,13-14H,9-12,15H2,1-4H3;5-8,13-14H,9-12H2,1-4H3;6-13H,4-5H2,1-3H3;2-9H,10H2,1H3/b;12-9+;;;;;
InChIKeyFQCOLTONSAJZPW-LJTYZUMUSA-N
MW2999.65 g/mol
LogP37.59
Rot. Bonds36

About 5-(1,3-benzothiazol-2-yl)-10,10,16,16-tetramethyl-3-oxa-13-azatetracyclo[7.7.1.02,7.013,17]heptadeca-1,5,7,9(17)-tetraen-4-one;3-[7-[bis(2-butoxyethyl)amino]-2-oxochromene-3-carbonyl]-7-methylchromen-2-one;3-[7-(dibutylamino)-2-oxochromene-3-carbonyl]-7-methylchromen-2-one;3-[7-(diethylamino)-2-oxochromene-3-carbonyl]-7-methylchromen-2-one;5-[(E)-3-[4-(dimethylamino)phenyl]prop-2-enoyl]-10,10,16,16-tetramethyl-3-oxa-13-azatetracyclo[7.7.1.02,7.013,17]heptadeca-1,5,7,9(17)-tetraen-4-one;3-(3H-indol-2-yl)-7-methylchromen-2-one;5-(3H-indol-2-yl)-10,10,16,16-tetramethyl-3-oxa-13-azatetracyclo[7.7.1.02,7.013,17]heptadeca-1,5,7,9(17)-tetraen-4-one

5-(1,3-benzothiazol-2-yl)-10,10,16,16-tetramethyl-3-oxa-13-azatetracyclo[7.7.1.02,7.013,17]heptadeca-1,5,7,9(17)-tetraen-4-one;3-[7-[bis(2-butoxyethyl)amino]-2-oxochromene-3-carbonyl]-7-methylchromen-2-one;3-[7-(dibutylamino)-2-oxochromene-3-carbonyl]-7-methylchromen-2-one;3-[7-(diethylamino)-2-oxochromene-3-carbonyl]-7-methylchromen-2-one;5-[(E)-3-[4-(dimethylamino)phenyl]prop-2-enoyl]-10,10,16,16-tetramethyl-3-oxa-13-azatetracyclo[7.7.1.02,7.013,17]heptadeca-1,5,7,9(17)-tetraen-4-one;3-(3H-indol-2-yl)-7-methylchromen-2-one;5-(3H-indol-2-yl)-10,10,16,16-tetramethyl-3-oxa-13-azatetracyclo[7.7.1.02,7.013,17]heptadeca-1,5,7,9(17)-tetraen-4-one (PubChem CID 158108354) has the molecular formula C185H188N10O26S and a molecular weight of 2999.65 g/mol. Its IUPAC name is 5-(1,3-benzothiazol-2-yl)-10,10,16,16-tetramethyl-3-oxa-13-azatetracyclo[7.7.1.02,7.013,17]heptadeca-1,5,7,9(17)-tetraen-4-one;3-[7-[bis(2-butoxyethyl)amino]-2-oxochromene-3-carbonyl]-7-methylchromen-2-one;3-[7-(dibutylamino)-2-oxochromene-3-carbonyl]-7-methylchromen-2-one;3-[7-(diethylamino)-2-oxochromene-3-carbonyl]-7-methylchromen-2-one;5-[(E)-3-[4-(dimethylamino)phenyl]prop-2-enoyl]-10,10,16,16-tetramethyl-3-oxa-13-azatetracyclo[7.7.1.02,7.013,17]heptadeca-1,5,7,9(17)-tetraen-4-one;3-(3H-indol-2-yl)-7-methylchromen-2-one;5-(3H-indol-2-yl)-10,10,16,16-tetramethyl-3-oxa-13-azatetracyclo[7.7.1.02,7.013,17]heptadeca-1,5,7,9(17)-tetraen-4-one.

Molecular Properties

Compound Name5-(1,3-benzothiazol-2-yl)-10,10,16,16-tetramethyl-3-oxa-13-azatetracyclo[7.7.1.02,7.013,17]heptadeca-1,5,7,9(17)-tetraen-4-one;3-[7-[bis(2-butoxyethyl)amino]-2-oxochromene-3-carbonyl]-7-methylchromen-2-one;3-[7-(dibutylamino)-2-oxochromene-3-carbonyl]-7-methylchromen-2-one;3-[7-(diethylamino)-2-oxochromene-3-carbonyl]-7-methylchromen-2-one;5-[(E)-3-[4-(dimethylamino)phenyl]prop-2-enoyl]-10,10,16,16-tetramethyl-3-oxa-13-azatetracyclo[7.7.1.02,7.013,17]heptadeca-1,5,7,9(17)-tetraen-4-one;3-(3H-indol-2-yl)-7-methylchromen-2-one;5-(3H-indol-2-yl)-10,10,16,16-tetramethyl-3-oxa-13-azatetracyclo[7.7.1.02,7.013,17]heptadeca-1,5,7,9(17)-tetraen-4-one
PubChem CID158108354
Molecular FormulaC185H188N10O26S
Molecular Weight2999.65 g/mol
Exact Mass2997.34
IUPAC Name5-(1,3-benzothiazol-2-yl)-10,10,16,16-tetramethyl-3-oxa-13-azatetracyclo[7.7.1.02,7.013,17]heptadeca-1,5,7,9(17)-tetraen-4-one;3-[7-[bis(2-butoxyethyl)amino]-2-oxochromene-3-carbonyl]-7-methylchromen-2-one;3-[7-(dibutylamino)-2-oxochromene-3-carbonyl]-7-methylchromen-2-one;3-[7-(diethylamino)-2-oxochromene-3-carbonyl]-7-methylchromen-2-one;5-[(E)-3-[4-(dimethylamino)phenyl]prop-2-enoyl]-10,10,16,16-tetramethyl-3-oxa-13-azatetracyclo[7.7.1.02,7.013,17]heptadeca-1,5,7,9(17)-tetraen-4-one;3-(3H-indol-2-yl)-7-methylchromen-2-one;5-(3H-indol-2-yl)-10,10,16,16-tetramethyl-3-oxa-13-azatetracyclo[7.7.1.02,7.013,17]heptadeca-1,5,7,9(17)-tetraen-4-one
SMILESCC1(C)CCN2CCC(C)(C)c3c2c1cc1cc(-c2nc4ccccc4s2)c(=O)oc31.CC1(C)CCN2CCC(C)(C)c3c2c1cc1cc(C2=Nc4ccccc4C2)c(=O)oc31.CCCCN(CCCC)c1ccc2cc(C(=O)c3cc4ccc(C)cc4oc3=O)c(=O)oc2c1.CCCCOCCN(CCOCCCC)c1ccc2cc(C(=O)c3cc4ccc(C)cc4oc3=O)c(=O)oc2c1.CCN(CC)c1ccc2cc(C(=O)c3cc4ccc(C)cc4oc3=O)c(=O)oc2c1.CN(C)c1ccc(/C=C/C(=O)c2cc3cc4c5c(c3oc2=O)C(C)(C)CCN5CCC4(C)C)cc1.Cc1ccc2cc(C3=Nc4ccccc4C3)c(=O)oc2c1
InChIInChI=1S/C32H37NO7.C30H34N2O3.C28H29NO5.C27H28N2O2.C26H26N2O2S.C24H21NO5.C18H13NO2/c1-4-6-14-37-16-12-33(13-17-38-15-7-5-2)25-11-10-24-20-27(32(36)40-29(24)21-25)30(34)26-19-23-9-8-22(3)18-28(23)39-31(26)35;1-29(2)13-15-32-16-14-30(3,4)25-26(32)23(29)18-20-17-22(28(34)35-27(20)25)24(33)12-9-19-7-10-21(11-8-19)31(5)6;1-4-6-12-29(13-7-5-2)21-11-10-20-16-23(28(32)34-25(20)17-21)26(30)22-15-19-9-8-18(3)14-24(19)33-27(22)31;1-26(2)9-11-29-12-10-27(3,4)22-23(29)19(26)14-17-13-18(25(30)31-24(17)22)21-15-16-7-5-6-8-20(16)28-21;1-25(2)9-11-28-12-10-26(3,4)20-21(28)17(25)14-15-13-16(24(29)30-22(15)20)23-27-18-7-5-6-8-19(18)31-23;1-4-25(5-2)17-9-8-16-12-19(24(28)30-21(16)13-17)22(26)18-11-15-7-6-14(3)10-20(15)29-23(18)27;1-11-6-7-13-9-14(18(20)21-17(13)8-11)16-10-12-4-2-3-5-15(12)19-16/h8-11,18-21H,4-7,12-17H2,1-3H3;7-12,17-18H,13-16H2,1-6H3;8-11,14-17H,4-7,12-13H2,1-3H3;5-8,13-14H,9-12,15H2,1-4H3;5-8,13-14H,9-12H2,1-4H3;6-13H,4-5H2,1-3H3;2-9H,10H2,1H3/b;12-9+;;;;;
InChIKeyFQCOLTONSAJZPW-LJTYZUMUSA-N
XLogP37.59
TPSA449.13 Ų
H-Bond Donors
H-Bond Acceptors37
Rotatable Bonds36
Heavy Atoms222
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002999.65
LogP ≤ 537.59
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1037

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'anil_di_alk_B(251)', 'substructure': 'N/A'}, {'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'cumarine', 'substructure': 'N/A'}, {'alert_name': 'Michael_acceptor_1', 'substructure': 'N/A'}

Analyze 5-(1,3-benzothiazol-2-yl)-10,10,16,16-tetramethyl-3-oxa-13-azatetracyclo[7.7.1.02,7.013,17]heptadeca-1,5,7,9(17)-tetraen-4-one;3-[7-[bis(2-butoxyethyl)amino]-2-oxochromene-3-carbonyl]-7-methylchromen-2-one;3-[7-(dibutylamino)-2-oxochromene-3-carbonyl]-7-methylchromen-2-one;3-[7-(diethylamino)-2-oxochromene-3-carbonyl]-7-methylchromen-2-one;5-[(E)-3-[4-(dimethylamino)phenyl]prop-2-enoyl]-10,10,16,16-tetramethyl-3-oxa-13-azatetracyclo[7.7.1.02,7.013,17]heptadeca-1,5,7,9(17)-tetraen-4-one;3-(3H-indol-2-yl)-7-methylchromen-2-one;5-(3H-indol-2-yl)-10,10,16,16-tetramethyl-3-oxa-13-azatetracyclo[7.7.1.02,7.013,17]heptadeca-1,5,7,9(17)-tetraen-4-one with MolForge

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Frequently Asked Questions

What is the IUPAC name of 5-(1,3-benzothiazol-2-yl)-10,10,16,16-tetramethyl-3-oxa-13-azatetracyclo[7.7.1.02,7.013,17]heptadeca-1,5,7,9(17)-tetraen-4-one;3-[7-[bis(2-butoxyethyl)amino]-2-oxochromene-3-carbonyl]-7-methylchromen-2-one;3-[7-(dibutylamino)-2-oxochromene-3-carbonyl]-7-methylchromen-2-one;3-[7-(diethylamino)-2-oxochromene-3-carbonyl]-7-methylchromen-2-one;5-[(E)-3-[4-(dimethylamino)phenyl]prop-2-enoyl]-10,10,16,16-tetramethyl-3-oxa-13-azatetracyclo[7.7.1.02,7.013,17]heptadeca-1,5,7,9(17)-tetraen-4-one;3-(3H-indol-2-yl)-7-methylchromen-2-one;5-(3H-indol-2-yl)-10,10,16,16-tetramethyl-3-oxa-13-azatetracyclo[7.7.1.02,7.013,17]heptadeca-1,5,7,9(17)-tetraen-4-one?
The IUPAC name of 5-(1,3-benzothiazol-2-yl)-10,10,16,16-tetramethyl-3-oxa-13-azatetracyclo[7.7.1.02,7.013,17]heptadeca-1,5,7,9(17)-tetraen-4-one;3-[7-[bis(2-butoxyethyl)amino]-2-oxochromene-3-carbonyl]-7-methylchromen-2-one;3-[7-(dibutylamino)-2-oxochromene-3-carbonyl]-7-methylchromen-2-one;3-[7-(diethylamino)-2-oxochromene-3-carbonyl]-7-methylchromen-2-one;5-[(E)-3-[4-(dimethylamino)phenyl]prop-2-enoyl]-10,10,16,16-tetramethyl-3-oxa-13-azatetracyclo[7.7.1.02,7.013,17]heptadeca-1,5,7,9(17)-tetraen-4-one;3-(3H-indol-2-yl)-7-methylchromen-2-one;5-(3H-indol-2-yl)-10,10,16,16-tetramethyl-3-oxa-13-azatetracyclo[7.7.1.02,7.013,17]heptadeca-1,5,7,9(17)-tetraen-4-one (CID 158108354) is 5-(1,3-benzothiazol-2-yl)-10,10,16,16-tetramethyl-3-oxa-13-azatetracyclo[7.7.1.02,7.013,17]heptadeca-1,5,7,9(17)-tetraen-4-one;3-[7-[bis(2-butoxyethyl)amino]-2-oxochromene-3-carbonyl]-7-methylchromen-2-one;3-[7-(dibutylamino)-2-oxochromene-3-carbonyl]-7-methylchromen-2-one;3-[7-(diethylamino)-2-oxochromene-3-carbonyl]-7-methylchromen-2-one;5-[(E)-3-[4-(dimethylamino)phenyl]prop-2-enoyl]-10,10,16,16-tetramethyl-3-oxa-13-azatetracyclo[7.7.1.02,7.013,17]heptadeca-1,5,7,9(17)-tetraen-4-one;3-(3H-indol-2-yl)-7-methylchromen-2-one;5-(3H-indol-2-yl)-10,10,16,16-tetramethyl-3-oxa-13-azatetracyclo[7.7.1.02,7.013,17]heptadeca-1,5,7,9(17)-tetraen-4-one.
What is the SMILES notation for 5-(1,3-benzothiazol-2-yl)-10,10,16,16-tetramethyl-3-oxa-13-azatetracyclo[7.7.1.02,7.013,17]heptadeca-1,5,7,9(17)-tetraen-4-one;3-[7-[bis(2-butoxyethyl)amino]-2-oxochromene-3-carbonyl]-7-methylchromen-2-one;3-[7-(dibutylamino)-2-oxochromene-3-carbonyl]-7-methylchromen-2-one;3-[7-(diethylamino)-2-oxochromene-3-carbonyl]-7-methylchromen-2-one;5-[(E)-3-[4-(dimethylamino)phenyl]prop-2-enoyl]-10,10,16,16-tetramethyl-3-oxa-13-azatetracyclo[7.7.1.02,7.013,17]heptadeca-1,5,7,9(17)-tetraen-4-one;3-(3H-indol-2-yl)-7-methylchromen-2-one;5-(3H-indol-2-yl)-10,10,16,16-tetramethyl-3-oxa-13-azatetracyclo[7.7.1.02,7.013,17]heptadeca-1,5,7,9(17)-tetraen-4-one?
The canonical SMILES for 5-(1,3-benzothiazol-2-yl)-10,10,16,16-tetramethyl-3-oxa-13-azatetracyclo[7.7.1.02,7.013,17]heptadeca-1,5,7,9(17)-tetraen-4-one;3-[7-[bis(2-butoxyethyl)amino]-2-oxochromene-3-carbonyl]-7-methylchromen-2-one;3-[7-(dibutylamino)-2-oxochromene-3-carbonyl]-7-methylchromen-2-one;3-[7-(diethylamino)-2-oxochromene-3-carbonyl]-7-methylchromen-2-one;5-[(E)-3-[4-(dimethylamino)phenyl]prop-2-enoyl]-10,10,16,16-tetramethyl-3-oxa-13-azatetracyclo[7.7.1.02,7.013,17]heptadeca-1,5,7,9(17)-tetraen-4-one;3-(3H-indol-2-yl)-7-methylchromen-2-one;5-(3H-indol-2-yl)-10,10,16,16-tetramethyl-3-oxa-13-azatetracyclo[7.7.1.02,7.013,17]heptadeca-1,5,7,9(17)-tetraen-4-one is CC1(C)CCN2CCC(C)(C)c3c2c1cc1cc(-c2nc4ccccc4s2)c(=O)oc31.CC1(C)CCN2CCC(C)(C)c3c2c1cc1cc(C2=Nc4ccccc4C2)c(=O)oc31.CCCCN(CCCC)c1ccc2cc(C(=O)c3cc4ccc(C)cc4oc3=O)c(=O)oc2c1.CCCCOCCN(CCOCCCC)c1ccc2cc(C(=O)c3cc4ccc(C)cc4oc3=O)c(=O)oc2c1.CCN(CC)c1ccc2cc(C(=O)c3cc4ccc(C)cc4oc3=O)c(=O)oc2c1.CN(C)c1ccc(/C=C/C(=O)c2cc3cc4c5c(c3oc2=O)C(C)(C)CCN5CCC4(C)C)cc1.Cc1ccc2cc(C3=Nc4ccccc4C3)c(=O)oc2c1.
What is the InChIKey of 5-(1,3-benzothiazol-2-yl)-10,10,16,16-tetramethyl-3-oxa-13-azatetracyclo[7.7.1.02,7.013,17]heptadeca-1,5,7,9(17)-tetraen-4-one;3-[7-[bis(2-butoxyethyl)amino]-2-oxochromene-3-carbonyl]-7-methylchromen-2-one;3-[7-(dibutylamino)-2-oxochromene-3-carbonyl]-7-methylchromen-2-one;3-[7-(diethylamino)-2-oxochromene-3-carbonyl]-7-methylchromen-2-one;5-[(E)-3-[4-(dimethylamino)phenyl]prop-2-enoyl]-10,10,16,16-tetramethyl-3-oxa-13-azatetracyclo[7.7.1.02,7.013,17]heptadeca-1,5,7,9(17)-tetraen-4-one;3-(3H-indol-2-yl)-7-methylchromen-2-one;5-(3H-indol-2-yl)-10,10,16,16-tetramethyl-3-oxa-13-azatetracyclo[7.7.1.02,7.013,17]heptadeca-1,5,7,9(17)-tetraen-4-one?
The InChIKey is FQCOLTONSAJZPW-LJTYZUMUSA-N. The full InChI is InChI=1S/C32H37NO7.C30H34N2O3.C28H29NO5.C27H28N2O2.C26H26N2O2S.C24H21NO5.C18H13NO2/c1-4-6-14-37-16-12-33(13-17-38-15-7-5-2)25-11-10-24-20-27(32(36)40-29(24)21-25)30(34)26-19-23-9-8-22(3)18-28(23)39-31(26)35;1-29(2)13-15-32-16-14-30(3,4)25-26(32)23(29)18-20-17-22(28(34)35-27(20)25)24(33)12-9-19-7-10-21(11-8-19)31(5)6;1-4-6-12-29(13-7-5-2)21-11-10-20-16-23(28(32)34-25(20)17-21)26(30)22-15-19-9-8-18(3)14-24(19)33-27(22)31;1-26(2)9-11-29-12-10-27(3,4)22-23(29)19(26)14-17-13-18(25(30)31-24(17)22)21-15-16-7-5-6-8-20(16)28-21;1-25(2)9-11-28-12-10-26(3,4)20-21(28)17(25)14-15-13-16(24(29)30-22(15)20)23-27-18-7-5-6-8-19(18)31-23;1-4-25(5-2)17-9-8-16-12-19(24(28)30-21(16)13-17)22(26)18-11-15-7-6-14(3)10-20(15)29-23(18)27;1-11-6-7-13-9-14(18(20)21-17(13)8-11)16-10-12-4-2-3-5-15(12)19-16/h8-11,18-21H,4-7,12-17H2,1-3H3;7-12,17-18H,13-16H2,1-6H3;8-11,14-17H,4-7,12-13H2,1-3H3;5-8,13-14H,9-12,15H2,1-4H3;5-8,13-14H,9-12H2,1-4H3;6-13H,4-5H2,1-3H3;2-9H,10H2,1H3/b;12-9+;;;;;.
What are the key properties of 5-(1,3-benzothiazol-2-yl)-10,10,16,16-tetramethyl-3-oxa-13-azatetracyclo[7.7.1.02,7.013,17]heptadeca-1,5,7,9(17)-tetraen-4-one;3-[7-[bis(2-butoxyethyl)amino]-2-oxochromene-3-carbonyl]-7-methylchromen-2-one;3-[7-(dibutylamino)-2-oxochromene-3-carbonyl]-7-methylchromen-2-one;3-[7-(diethylamino)-2-oxochromene-3-carbonyl]-7-methylchromen-2-one;5-[(E)-3-[4-(dimethylamino)phenyl]prop-2-enoyl]-10,10,16,16-tetramethyl-3-oxa-13-azatetracyclo[7.7.1.02,7.013,17]heptadeca-1,5,7,9(17)-tetraen-4-one;3-(3H-indol-2-yl)-7-methylchromen-2-one;5-(3H-indol-2-yl)-10,10,16,16-tetramethyl-3-oxa-13-azatetracyclo[7.7.1.02,7.013,17]heptadeca-1,5,7,9(17)-tetraen-4-one?
5-(1,3-benzothiazol-2-yl)-10,10,16,16-tetramethyl-3-oxa-13-azatetracyclo[7.7.1.02,7.013,17]heptadeca-1,5,7,9(17)-tetraen-4-one;3-[7-[bis(2-butoxyethyl)amino]-2-oxochromene-3-carbonyl]-7-methylchromen-2-one;3-[7-(dibutylamino)-2-oxochromene-3-carbonyl]-7-methylchromen-2-one;3-[7-(diethylamino)-2-oxochromene-3-carbonyl]-7-methylchromen-2-one;5-[(E)-3-[4-(dimethylamino)phenyl]prop-2-enoyl]-10,10,16,16-tetramethyl-3-oxa-13-azatetracyclo[7.7.1.02,7.013,17]heptadeca-1,5,7,9(17)-tetraen-4-one;3-(3H-indol-2-yl)-7-methylchromen-2-one;5-(3H-indol-2-yl)-10,10,16,16-tetramethyl-3-oxa-13-azatetracyclo[7.7.1.02,7.013,17]heptadeca-1,5,7,9(17)-tetraen-4-one has a molecular weight of 2999.65 g/mol, XLogP of 37.59, 36 rotatable bonds, 0 hydrogen bond donors, and 37 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(1,3-benzothiazol-2-yl)-10,10,16,16-tetramethyl-3-oxa-13-azatetracyclo[7.7.1.02,7.013,17]heptadeca-1,5,7,9(17)-tetraen-4-one;3-[7-[bis(2-butoxyethyl)amino]-2-oxochromene-3-carbonyl]-7-methylchromen-2-one;3-[7-(dibutylamino)-2-oxochromene-3-carbonyl]-7-methylchromen-2-one;3-[7-(diethylamino)-2-oxochromene-3-carbonyl]-7-methylchromen-2-one;5-[(E)-3-[4-(dimethylamino)phenyl]prop-2-enoyl]-10,10,16,16-tetramethyl-3-oxa-13-azatetracyclo[7.7.1.02,7.013,17]heptadeca-1,5,7,9(17)-tetraen-4-one;3-(3H-indol-2-yl)-7-methylchromen-2-one;5-(3H-indol-2-yl)-10,10,16,16-tetramethyl-3-oxa-13-azatetracyclo[7.7.1.02,7.013,17]heptadeca-1,5,7,9(17)-tetraen-4-one is sourced from PubChem (CID 158108354), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).