3-[2-(3,4-dimethylphenyl)cyclopropanecarbonyl]-1H-benzimidazol-2-one;[2-(3,4-dimethylphenyl)cyclopropyl]-(2-sulfanylidene-3H-benzimidazol-1-yl)methanone;bis((E)-3-(3,4-dimethylphenyl)-1-(2H-[1,3]oxazolo[5,4-c]pyridin-1-yl)prop-2-en-1-one);1-[(E)-3-(3,4-dimethylphenyl)prop-2-enoyl]-[1,3]oxazolo[5,4-b]pyridin-2-one;(E)-3-[4-(ethynoxymethyl)-3-methylphenyl]-1-(2-sulfanylidene-[1,3]oxazolo[5,4-c]pyridin-1-yl)prop-2-en-1-one;3-[(E)-2-(3-methoxy-4,5-dimethylphenyl)ethenyl]sulfonyl-[1,3]thiazolo[4,5-c]pyridine-2-thione;1-[(E)-2-(3-methoxy-4,5-dimethylphenyl)ethenyl]sulfonyl-[1,3]thiazolo[5,4-c]pyridin-2-one

C142H128N16O20S7 — CID 158860277

IUPAC3-[2-(3,4-dimethylphenyl)cyclopropanecarbonyl]-1H-benzimidazol-2-one;[2-(3,4-dimethylphenyl)cyclopropyl]-(2-sulfanylidene-3H-benzimidazol-1-yl)methanone;bis((E)-3-(3,4-dimethylphenyl)-1-(2H-[1,3]oxazolo[5,4-c]pyridin-1-yl)prop-2-en-1-one);1-[(E)-3-(3,4-dimethylphenyl)prop-2-enoyl]-[1,3]oxazolo[5,4-b]pyridin-2-one;(E)-3-[4-(ethynoxymethyl)-3-methylphenyl]-1-(2-sulfanylidene-[1,3]oxazolo[5,4-c]pyridin-1-yl)prop-2-en-1-one;3-[(E)-2-(3-methoxy-4,5-dimethylphenyl)ethenyl]sulfonyl-[1,3]thiazolo[4,5-c]pyridine-2-thione;1-[(E)-2-(3-methoxy-4,5-dimethylphenyl)ethenyl]sulfonyl-[1,3]thiazolo[5,4-c]pyridin-2-one
SMILESC#COCc1ccc(/C=C/C(=O)n2c(=S)oc3cnccc32)cc1C.COc1cc(/C=C/S(=O)(=O)n2c(=O)sc3cnccc32)cc(C)c1C.COc1cc(/C=C/S(=O)(=O)n2c(=S)sc3ccncc32)cc(C)c1C.Cc1ccc(/C=C/C(=O)N2COc3cnccc32)cc1C.Cc1ccc(/C=C/C(=O)N2COc3cnccc32)cc1C.Cc1ccc(/C=C/C(=O)n2c(=O)oc3ncccc32)cc1C.Cc1ccc(C2CC2C(=O)n2c(=O)[nH]c3ccccc32)cc1C.Cc1ccc(C2CC2C(=O)n2c(=S)[nH]c3ccccc32)cc1C
InChIInChI=1S/C19H14N2O3S.C19H18N2O2.C19H18N2OS.C17H16N2O4S2.C17H16N2O3S3.C17H14N2O3.2C17H16N2O2/c1-3-23-12-15-6-4-14(10-13(15)2)5-7-18(22)21-16-8-9-20-11-17(16)24-19(21)25;2*1-11-7-8-13(9-12(11)2)14-10-15(14)18(22)21-17-6-4-3-5-16(17)20-19(21)23;1-11-8-13(9-15(23-3)12(11)2)5-7-25(21,22)19-14-4-6-18-10-16(14)24-17(19)20;1-11-8-13(9-15(22-3)12(11)2)5-7-25(20,21)19-14-10-18-6-4-16(14)24-17(19)23;1-11-5-6-13(10-12(11)2)7-8-15(20)19-14-4-3-9-18-16(14)22-17(19)21;2*1-12-3-4-14(9-13(12)2)5-6-17(20)19-11-21-16-10-18-8-7-15(16)19/h1,4-11H,12H2,2H3;2*3-9,14-15H,10H2,1-2H3,(H,20,23);2*4-10H,1-3H3;3-10H,1-2H3;2*3-10H,11H2,1-2H3/b7-5+;;;2*7-5+;8-7+;2*6-5+
InChIKeyJAOJJXNSJSLSRQ-HEDJXUOXSA-N
MW2603.15 g/mol
LogP28.66
Rot. Bonds22

About 3-[2-(3,4-dimethylphenyl)cyclopropanecarbonyl]-1H-benzimidazol-2-one;[2-(3,4-dimethylphenyl)cyclopropyl]-(2-sulfanylidene-3H-benzimidazol-1-yl)methanone;bis((E)-3-(3,4-dimethylphenyl)-1-(2H-[1,3]oxazolo[5,4-c]pyridin-1-yl)prop-2-en-1-one);1-[(E)-3-(3,4-dimethylphenyl)prop-2-enoyl]-[1,3]oxazolo[5,4-b]pyridin-2-one;(E)-3-[4-(ethynoxymethyl)-3-methylphenyl]-1-(2-sulfanylidene-[1,3]oxazolo[5,4-c]pyridin-1-yl)prop-2-en-1-one;3-[(E)-2-(3-methoxy-4,5-dimethylphenyl)ethenyl]sulfonyl-[1,3]thiazolo[4,5-c]pyridine-2-thione;1-[(E)-2-(3-methoxy-4,5-dimethylphenyl)ethenyl]sulfonyl-[1,3]thiazolo[5,4-c]pyridin-2-one

3-[2-(3,4-dimethylphenyl)cyclopropanecarbonyl]-1H-benzimidazol-2-one;[2-(3,4-dimethylphenyl)cyclopropyl]-(2-sulfanylidene-3H-benzimidazol-1-yl)methanone;bis((E)-3-(3,4-dimethylphenyl)-1-(2H-[1,3]oxazolo[5,4-c]pyridin-1-yl)prop-2-en-1-one);1-[(E)-3-(3,4-dimethylphenyl)prop-2-enoyl]-[1,3]oxazolo[5,4-b]pyridin-2-one;(E)-3-[4-(ethynoxymethyl)-3-methylphenyl]-1-(2-sulfanylidene-[1,3]oxazolo[5,4-c]pyridin-1-yl)prop-2-en-1-one;3-[(E)-2-(3-methoxy-4,5-dimethylphenyl)ethenyl]sulfonyl-[1,3]thiazolo[4,5-c]pyridine-2-thione;1-[(E)-2-(3-methoxy-4,5-dimethylphenyl)ethenyl]sulfonyl-[1,3]thiazolo[5,4-c]pyridin-2-one (PubChem CID 158860277) has the molecular formula C142H128N16O20S7 and a molecular weight of 2603.15 g/mol. Its IUPAC name is 3-[2-(3,4-dimethylphenyl)cyclopropanecarbonyl]-1H-benzimidazol-2-one;[2-(3,4-dimethylphenyl)cyclopropyl]-(2-sulfanylidene-3H-benzimidazol-1-yl)methanone;bis((E)-3-(3,4-dimethylphenyl)-1-(2H-[1,3]oxazolo[5,4-c]pyridin-1-yl)prop-2-en-1-one);1-[(E)-3-(3,4-dimethylphenyl)prop-2-enoyl]-[1,3]oxazolo[5,4-b]pyridin-2-one;(E)-3-[4-(ethynoxymethyl)-3-methylphenyl]-1-(2-sulfanylidene-[1,3]oxazolo[5,4-c]pyridin-1-yl)prop-2-en-1-one;3-[(E)-2-(3-methoxy-4,5-dimethylphenyl)ethenyl]sulfonyl-[1,3]thiazolo[4,5-c]pyridine-2-thione;1-[(E)-2-(3-methoxy-4,5-dimethylphenyl)ethenyl]sulfonyl-[1,3]thiazolo[5,4-c]pyridin-2-one.

Molecular Properties

Compound Name3-[2-(3,4-dimethylphenyl)cyclopropanecarbonyl]-1H-benzimidazol-2-one;[2-(3,4-dimethylphenyl)cyclopropyl]-(2-sulfanylidene-3H-benzimidazol-1-yl)methanone;bis((E)-3-(3,4-dimethylphenyl)-1-(2H-[1,3]oxazolo[5,4-c]pyridin-1-yl)prop-2-en-1-one);1-[(E)-3-(3,4-dimethylphenyl)prop-2-enoyl]-[1,3]oxazolo[5,4-b]pyridin-2-one;(E)-3-[4-(ethynoxymethyl)-3-methylphenyl]-1-(2-sulfanylidene-[1,3]oxazolo[5,4-c]pyridin-1-yl)prop-2-en-1-one;3-[(E)-2-(3-methoxy-4,5-dimethylphenyl)ethenyl]sulfonyl-[1,3]thiazolo[4,5-c]pyridine-2-thione;1-[(E)-2-(3-methoxy-4,5-dimethylphenyl)ethenyl]sulfonyl-[1,3]thiazolo[5,4-c]pyridin-2-one
PubChem CID158860277
Molecular FormulaC142H128N16O20S7
Molecular Weight2603.15 g/mol
Exact Mass2600.75
IUPAC Name3-[2-(3,4-dimethylphenyl)cyclopropanecarbonyl]-1H-benzimidazol-2-one;[2-(3,4-dimethylphenyl)cyclopropyl]-(2-sulfanylidene-3H-benzimidazol-1-yl)methanone;bis((E)-3-(3,4-dimethylphenyl)-1-(2H-[1,3]oxazolo[5,4-c]pyridin-1-yl)prop-2-en-1-one);1-[(E)-3-(3,4-dimethylphenyl)prop-2-enoyl]-[1,3]oxazolo[5,4-b]pyridin-2-one;(E)-3-[4-(ethynoxymethyl)-3-methylphenyl]-1-(2-sulfanylidene-[1,3]oxazolo[5,4-c]pyridin-1-yl)prop-2-en-1-one;3-[(E)-2-(3-methoxy-4,5-dimethylphenyl)ethenyl]sulfonyl-[1,3]thiazolo[4,5-c]pyridine-2-thione;1-[(E)-2-(3-methoxy-4,5-dimethylphenyl)ethenyl]sulfonyl-[1,3]thiazolo[5,4-c]pyridin-2-one
SMILESC#COCc1ccc(/C=C/C(=O)n2c(=S)oc3cnccc32)cc1C.COc1cc(/C=C/S(=O)(=O)n2c(=O)sc3cnccc32)cc(C)c1C.COc1cc(/C=C/S(=O)(=O)n2c(=S)sc3ccncc32)cc(C)c1C.Cc1ccc(/C=C/C(=O)N2COc3cnccc32)cc1C.Cc1ccc(/C=C/C(=O)N2COc3cnccc32)cc1C.Cc1ccc(/C=C/C(=O)n2c(=O)oc3ncccc32)cc1C.Cc1ccc(C2CC2C(=O)n2c(=O)[nH]c3ccccc32)cc1C.Cc1ccc(C2CC2C(=O)n2c(=S)[nH]c3ccccc32)cc1C
InChIInChI=1S/C19H14N2O3S.C19H18N2O2.C19H18N2OS.C17H16N2O4S2.C17H16N2O3S3.C17H14N2O3.2C17H16N2O2/c1-3-23-12-15-6-4-14(10-13(15)2)5-7-18(22)21-16-8-9-20-11-17(16)24-19(21)25;2*1-11-7-8-13(9-12(11)2)14-10-15(14)18(22)21-17-6-4-3-5-16(17)20-19(21)23;1-11-8-13(9-15(23-3)12(11)2)5-7-25(21,22)19-14-4-6-18-10-16(14)24-17(19)20;1-11-8-13(9-15(22-3)12(11)2)5-7-25(20,21)19-14-10-18-6-4-16(14)24-17(19)23;1-11-5-6-13(10-12(11)2)7-8-15(20)19-14-4-3-9-18-16(14)22-17(19)21;2*1-12-3-4-14(9-13(12)2)5-6-17(20)19-11-21-16-10-18-8-7-15(16)19/h1,4-11H,12H2,2H3;2*3-9,14-15H,10H2,1-2H3,(H,20,23);2*4-10H,1-3H3;3-10H,1-2H3;2*3-10H,11H2,1-2H3/b7-5+;;;2*7-5+;8-7+;2*6-5+
InChIKeyJAOJJXNSJSLSRQ-HEDJXUOXSA-N
XLogP28.66
TPSA439.32 Ų
H-Bond Donors2
H-Bond Acceptors37
Rotatable Bonds22
Heavy Atoms185
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002603.15
LogP ≤ 528.66
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 1037

Computed Properties (RDKit)

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

Analyze 3-[2-(3,4-dimethylphenyl)cyclopropanecarbonyl]-1H-benzimidazol-2-one;[2-(3,4-dimethylphenyl)cyclopropyl]-(2-sulfanylidene-3H-benzimidazol-1-yl)methanone;bis((E)-3-(3,4-dimethylphenyl)-1-(2H-[1,3]oxazolo[5,4-c]pyridin-1-yl)prop-2-en-1-one);1-[(E)-3-(3,4-dimethylphenyl)prop-2-enoyl]-[1,3]oxazolo[5,4-b]pyridin-2-one;(E)-3-[4-(ethynoxymethyl)-3-methylphenyl]-1-(2-sulfanylidene-[1,3]oxazolo[5,4-c]pyridin-1-yl)prop-2-en-1-one;3-[(E)-2-(3-methoxy-4,5-dimethylphenyl)ethenyl]sulfonyl-[1,3]thiazolo[4,5-c]pyridine-2-thione;1-[(E)-2-(3-methoxy-4,5-dimethylphenyl)ethenyl]sulfonyl-[1,3]thiazolo[5,4-c]pyridin-2-one with MolForge

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Frequently Asked Questions

What is the IUPAC name of 3-[2-(3,4-dimethylphenyl)cyclopropanecarbonyl]-1H-benzimidazol-2-one;[2-(3,4-dimethylphenyl)cyclopropyl]-(2-sulfanylidene-3H-benzimidazol-1-yl)methanone;bis((E)-3-(3,4-dimethylphenyl)-1-(2H-[1,3]oxazolo[5,4-c]pyridin-1-yl)prop-2-en-1-one);1-[(E)-3-(3,4-dimethylphenyl)prop-2-enoyl]-[1,3]oxazolo[5,4-b]pyridin-2-one;(E)-3-[4-(ethynoxymethyl)-3-methylphenyl]-1-(2-sulfanylidene-[1,3]oxazolo[5,4-c]pyridin-1-yl)prop-2-en-1-one;3-[(E)-2-(3-methoxy-4,5-dimethylphenyl)ethenyl]sulfonyl-[1,3]thiazolo[4,5-c]pyridine-2-thione;1-[(E)-2-(3-methoxy-4,5-dimethylphenyl)ethenyl]sulfonyl-[1,3]thiazolo[5,4-c]pyridin-2-one?
The IUPAC name of 3-[2-(3,4-dimethylphenyl)cyclopropanecarbonyl]-1H-benzimidazol-2-one;[2-(3,4-dimethylphenyl)cyclopropyl]-(2-sulfanylidene-3H-benzimidazol-1-yl)methanone;bis((E)-3-(3,4-dimethylphenyl)-1-(2H-[1,3]oxazolo[5,4-c]pyridin-1-yl)prop-2-en-1-one);1-[(E)-3-(3,4-dimethylphenyl)prop-2-enoyl]-[1,3]oxazolo[5,4-b]pyridin-2-one;(E)-3-[4-(ethynoxymethyl)-3-methylphenyl]-1-(2-sulfanylidene-[1,3]oxazolo[5,4-c]pyridin-1-yl)prop-2-en-1-one;3-[(E)-2-(3-methoxy-4,5-dimethylphenyl)ethenyl]sulfonyl-[1,3]thiazolo[4,5-c]pyridine-2-thione;1-[(E)-2-(3-methoxy-4,5-dimethylphenyl)ethenyl]sulfonyl-[1,3]thiazolo[5,4-c]pyridin-2-one (CID 158860277) is 3-[2-(3,4-dimethylphenyl)cyclopropanecarbonyl]-1H-benzimidazol-2-one;[2-(3,4-dimethylphenyl)cyclopropyl]-(2-sulfanylidene-3H-benzimidazol-1-yl)methanone;bis((E)-3-(3,4-dimethylphenyl)-1-(2H-[1,3]oxazolo[5,4-c]pyridin-1-yl)prop-2-en-1-one);1-[(E)-3-(3,4-dimethylphenyl)prop-2-enoyl]-[1,3]oxazolo[5,4-b]pyridin-2-one;(E)-3-[4-(ethynoxymethyl)-3-methylphenyl]-1-(2-sulfanylidene-[1,3]oxazolo[5,4-c]pyridin-1-yl)prop-2-en-1-one;3-[(E)-2-(3-methoxy-4,5-dimethylphenyl)ethenyl]sulfonyl-[1,3]thiazolo[4,5-c]pyridine-2-thione;1-[(E)-2-(3-methoxy-4,5-dimethylphenyl)ethenyl]sulfonyl-[1,3]thiazolo[5,4-c]pyridin-2-one.
What is the SMILES notation for 3-[2-(3,4-dimethylphenyl)cyclopropanecarbonyl]-1H-benzimidazol-2-one;[2-(3,4-dimethylphenyl)cyclopropyl]-(2-sulfanylidene-3H-benzimidazol-1-yl)methanone;bis((E)-3-(3,4-dimethylphenyl)-1-(2H-[1,3]oxazolo[5,4-c]pyridin-1-yl)prop-2-en-1-one);1-[(E)-3-(3,4-dimethylphenyl)prop-2-enoyl]-[1,3]oxazolo[5,4-b]pyridin-2-one;(E)-3-[4-(ethynoxymethyl)-3-methylphenyl]-1-(2-sulfanylidene-[1,3]oxazolo[5,4-c]pyridin-1-yl)prop-2-en-1-one;3-[(E)-2-(3-methoxy-4,5-dimethylphenyl)ethenyl]sulfonyl-[1,3]thiazolo[4,5-c]pyridine-2-thione;1-[(E)-2-(3-methoxy-4,5-dimethylphenyl)ethenyl]sulfonyl-[1,3]thiazolo[5,4-c]pyridin-2-one?
The canonical SMILES for 3-[2-(3,4-dimethylphenyl)cyclopropanecarbonyl]-1H-benzimidazol-2-one;[2-(3,4-dimethylphenyl)cyclopropyl]-(2-sulfanylidene-3H-benzimidazol-1-yl)methanone;bis((E)-3-(3,4-dimethylphenyl)-1-(2H-[1,3]oxazolo[5,4-c]pyridin-1-yl)prop-2-en-1-one);1-[(E)-3-(3,4-dimethylphenyl)prop-2-enoyl]-[1,3]oxazolo[5,4-b]pyridin-2-one;(E)-3-[4-(ethynoxymethyl)-3-methylphenyl]-1-(2-sulfanylidene-[1,3]oxazolo[5,4-c]pyridin-1-yl)prop-2-en-1-one;3-[(E)-2-(3-methoxy-4,5-dimethylphenyl)ethenyl]sulfonyl-[1,3]thiazolo[4,5-c]pyridine-2-thione;1-[(E)-2-(3-methoxy-4,5-dimethylphenyl)ethenyl]sulfonyl-[1,3]thiazolo[5,4-c]pyridin-2-one is C#COCc1ccc(/C=C/C(=O)n2c(=S)oc3cnccc32)cc1C.COc1cc(/C=C/S(=O)(=O)n2c(=O)sc3cnccc32)cc(C)c1C.COc1cc(/C=C/S(=O)(=O)n2c(=S)sc3ccncc32)cc(C)c1C.Cc1ccc(/C=C/C(=O)N2COc3cnccc32)cc1C.Cc1ccc(/C=C/C(=O)N2COc3cnccc32)cc1C.Cc1ccc(/C=C/C(=O)n2c(=O)oc3ncccc32)cc1C.Cc1ccc(C2CC2C(=O)n2c(=O)[nH]c3ccccc32)cc1C.Cc1ccc(C2CC2C(=O)n2c(=S)[nH]c3ccccc32)cc1C.
What is the InChIKey of 3-[2-(3,4-dimethylphenyl)cyclopropanecarbonyl]-1H-benzimidazol-2-one;[2-(3,4-dimethylphenyl)cyclopropyl]-(2-sulfanylidene-3H-benzimidazol-1-yl)methanone;bis((E)-3-(3,4-dimethylphenyl)-1-(2H-[1,3]oxazolo[5,4-c]pyridin-1-yl)prop-2-en-1-one);1-[(E)-3-(3,4-dimethylphenyl)prop-2-enoyl]-[1,3]oxazolo[5,4-b]pyridin-2-one;(E)-3-[4-(ethynoxymethyl)-3-methylphenyl]-1-(2-sulfanylidene-[1,3]oxazolo[5,4-c]pyridin-1-yl)prop-2-en-1-one;3-[(E)-2-(3-methoxy-4,5-dimethylphenyl)ethenyl]sulfonyl-[1,3]thiazolo[4,5-c]pyridine-2-thione;1-[(E)-2-(3-methoxy-4,5-dimethylphenyl)ethenyl]sulfonyl-[1,3]thiazolo[5,4-c]pyridin-2-one?
The InChIKey is JAOJJXNSJSLSRQ-HEDJXUOXSA-N. The full InChI is InChI=1S/C19H14N2O3S.C19H18N2O2.C19H18N2OS.C17H16N2O4S2.C17H16N2O3S3.C17H14N2O3.2C17H16N2O2/c1-3-23-12-15-6-4-14(10-13(15)2)5-7-18(22)21-16-8-9-20-11-17(16)24-19(21)25;2*1-11-7-8-13(9-12(11)2)14-10-15(14)18(22)21-17-6-4-3-5-16(17)20-19(21)23;1-11-8-13(9-15(23-3)12(11)2)5-7-25(21,22)19-14-4-6-18-10-16(14)24-17(19)20;1-11-8-13(9-15(22-3)12(11)2)5-7-25(20,21)19-14-10-18-6-4-16(14)24-17(19)23;1-11-5-6-13(10-12(11)2)7-8-15(20)19-14-4-3-9-18-16(14)22-17(19)21;2*1-12-3-4-14(9-13(12)2)5-6-17(20)19-11-21-16-10-18-8-7-15(16)19/h1,4-11H,12H2,2H3;2*3-9,14-15H,10H2,1-2H3,(H,20,23);2*4-10H,1-3H3;3-10H,1-2H3;2*3-10H,11H2,1-2H3/b7-5+;;;2*7-5+;8-7+;2*6-5+.
What are the key properties of 3-[2-(3,4-dimethylphenyl)cyclopropanecarbonyl]-1H-benzimidazol-2-one;[2-(3,4-dimethylphenyl)cyclopropyl]-(2-sulfanylidene-3H-benzimidazol-1-yl)methanone;bis((E)-3-(3,4-dimethylphenyl)-1-(2H-[1,3]oxazolo[5,4-c]pyridin-1-yl)prop-2-en-1-one);1-[(E)-3-(3,4-dimethylphenyl)prop-2-enoyl]-[1,3]oxazolo[5,4-b]pyridin-2-one;(E)-3-[4-(ethynoxymethyl)-3-methylphenyl]-1-(2-sulfanylidene-[1,3]oxazolo[5,4-c]pyridin-1-yl)prop-2-en-1-one;3-[(E)-2-(3-methoxy-4,5-dimethylphenyl)ethenyl]sulfonyl-[1,3]thiazolo[4,5-c]pyridine-2-thione;1-[(E)-2-(3-methoxy-4,5-dimethylphenyl)ethenyl]sulfonyl-[1,3]thiazolo[5,4-c]pyridin-2-one?
3-[2-(3,4-dimethylphenyl)cyclopropanecarbonyl]-1H-benzimidazol-2-one;[2-(3,4-dimethylphenyl)cyclopropyl]-(2-sulfanylidene-3H-benzimidazol-1-yl)methanone;bis((E)-3-(3,4-dimethylphenyl)-1-(2H-[1,3]oxazolo[5,4-c]pyridin-1-yl)prop-2-en-1-one);1-[(E)-3-(3,4-dimethylphenyl)prop-2-enoyl]-[1,3]oxazolo[5,4-b]pyridin-2-one;(E)-3-[4-(ethynoxymethyl)-3-methylphenyl]-1-(2-sulfanylidene-[1,3]oxazolo[5,4-c]pyridin-1-yl)prop-2-en-1-one;3-[(E)-2-(3-methoxy-4,5-dimethylphenyl)ethenyl]sulfonyl-[1,3]thiazolo[4,5-c]pyridine-2-thione;1-[(E)-2-(3-methoxy-4,5-dimethylphenyl)ethenyl]sulfonyl-[1,3]thiazolo[5,4-c]pyridin-2-one has a molecular weight of 2603.15 g/mol, XLogP of 28.66, 22 rotatable bonds, 2 hydrogen bond donors, and 37 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[2-(3,4-dimethylphenyl)cyclopropanecarbonyl]-1H-benzimidazol-2-one;[2-(3,4-dimethylphenyl)cyclopropyl]-(2-sulfanylidene-3H-benzimidazol-1-yl)methanone;bis((E)-3-(3,4-dimethylphenyl)-1-(2H-[1,3]oxazolo[5,4-c]pyridin-1-yl)prop-2-en-1-one);1-[(E)-3-(3,4-dimethylphenyl)prop-2-enoyl]-[1,3]oxazolo[5,4-b]pyridin-2-one;(E)-3-[4-(ethynoxymethyl)-3-methylphenyl]-1-(2-sulfanylidene-[1,3]oxazolo[5,4-c]pyridin-1-yl)prop-2-en-1-one;3-[(E)-2-(3-methoxy-4,5-dimethylphenyl)ethenyl]sulfonyl-[1,3]thiazolo[4,5-c]pyridine-2-thione;1-[(E)-2-(3-methoxy-4,5-dimethylphenyl)ethenyl]sulfonyl-[1,3]thiazolo[5,4-c]pyridin-2-one is sourced from PubChem (CID 158860277), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).