5,7-bis(3,5-dimethyl-1,2-oxazol-4-yl)-3H-1,3-benzoxazol-2-one;4,6-bis(3,5-dimethyl-1,2-oxazol-4-yl)-1,3-dihydrobenzimidazol-2-one;4,6-bis(3,5-dimethyl-1,2-oxazol-4-yl)-3-methyl-1H-benzimidazol-2-one;6-(3,5-dimethyl-1,2-oxazol-4-yl)-4-(1,4-dimethylpyrazol-5-yl)-1,3-dihydrobenzimidazol-2-one;6-(3,5-dimethyl-1,2-oxazol-4-yl)-4-(1,4-dimethylpyrazol-5-yl)-3-methyl-1H-benzimidazol-2-one;6-(3,5-dimethyl-1,2-oxazol-4-yl)-3-methyl-4-(6-methylquinolin-5-yl)-1H-benzimidazol-2-one;5-(3,5-dimethyl-1,2-oxazol-4-yl)-7-(6-methylquinolin-5-yl)-3H-1,3-benzoxazol-2-one;6-(3,5-dimethyl-1,2-oxazol-4-yl)-4-(6-methylquinolin-5-yl)-1,3-dihydrobenzimidazol-2-one;5-[6-(3,5-dimethyl-1,2-oxazol-4-yl)-2-oxo-1,3-dihydrobenzimidazol-4-yl]-1,6-dimethyl-3,4-dihydroquinolin-2-one;6-(3,5-dimethyl-1,2-oxazol-4-yl)-4-(2-phenylphenyl)-1,3-dihydrobenzimidazol-2-one

C201H181N39O26 — CID 157151951

IUPAC5,7-bis(3,5-dimethyl-1,2-oxazol-4-yl)-3H-1,3-benzoxazol-2-one;4,6-bis(3,5-dimethyl-1,2-oxazol-4-yl)-1,3-dihydrobenzimidazol-2-one;4,6-bis(3,5-dimethyl-1,2-oxazol-4-yl)-3-methyl-1H-benzimidazol-2-one;6-(3,5-dimethyl-1,2-oxazol-4-yl)-4-(1,4-dimethylpyrazol-5-yl)-1,3-dihydrobenzimidazol-2-one;6-(3,5-dimethyl-1,2-oxazol-4-yl)-4-(1,4-dimethylpyrazol-5-yl)-3-methyl-1H-benzimidazol-2-one;6-(3,5-dimethyl-1,2-oxazol-4-yl)-3-methyl-4-(6-methylquinolin-5-yl)-1H-benzimidazol-2-one;5-(3,5-dimethyl-1,2-oxazol-4-yl)-7-(6-methylquinolin-5-yl)-3H-1,3-benzoxazol-2-one;6-(3,5-dimethyl-1,2-oxazol-4-yl)-4-(6-methylquinolin-5-yl)-1,3-dihydrobenzimidazol-2-one;5-[6-(3,5-dimethyl-1,2-oxazol-4-yl)-2-oxo-1,3-dihydrobenzimidazol-4-yl]-1,6-dimethyl-3,4-dihydroquinolin-2-one;6-(3,5-dimethyl-1,2-oxazol-4-yl)-4-(2-phenylphenyl)-1,3-dihydrobenzimidazol-2-one
SMILESCc1ccc2c(c1-c1cc(-c3c(C)noc3C)cc3[nH]c(=O)[nH]c13)CCC(=O)N2C.Cc1ccc2ncccc2c1-c1cc(-c2c(C)noc2C)cc2[nH]c(=O)[nH]c12.Cc1ccc2ncccc2c1-c1cc(-c2c(C)noc2C)cc2[nH]c(=O)n(C)c12.Cc1ccc2ncccc2c1-c1cc(-c2c(C)noc2C)cc2[nH]c(=O)oc12.Cc1cnn(C)c1-c1cc(-c2c(C)noc2C)cc2[nH]c(=O)[nH]c12.Cc1cnn(C)c1-c1cc(-c2c(C)noc2C)cc2[nH]c(=O)n(C)c12.Cc1noc(C)c1-c1cc(-c2c(C)noc2C)c2[nH]c(=O)[nH]c2c1.Cc1noc(C)c1-c1cc(-c2c(C)noc2C)c2c(c1)[nH]c(=O)n2C.Cc1noc(C)c1-c1cc(-c2c(C)noc2C)c2oc(=O)[nH]c2c1.Cc1noc(C)c1-c1cc(-c2ccccc2-c2ccccc2)c2[nH]c(=O)[nH]c2c1
InChIInChI=1S/C24H19N3O2.C23H22N4O3.C23H20N4O2.C22H18N4O2.C22H17N3O3.C18H19N5O2.C18H18N4O3.C17H17N5O2.C17H16N4O3.C17H15N3O4/c1-14-22(15(2)29-27-14)17-12-20(23-21(13-17)25-24(28)26-23)19-11-7-6-10-18(19)16-8-4-3-5-9-16;1-11-5-7-18-15(6-8-19(28)27(18)4)20(11)16-9-14(21-12(2)26-30-13(21)3)10-17-22(16)25-23(29)24-17;1-12-7-8-18-16(6-5-9-24-18)20(12)17-10-15(21-13(2)26-29-14(21)3)11-19-22(17)27(4)23(28)25-19;1-11-6-7-17-15(5-4-8-23-17)19(11)16-9-14(20-12(2)26-28-13(20)3)10-18-21(16)25-22(27)24-18;1-11-6-7-17-15(5-4-8-23-17)19(11)16-9-14(20-12(2)25-28-13(20)3)10-18-21(16)27-22(26)24-18;1-9-8-19-23(5)16(9)13-6-12(15-10(2)21-25-11(15)3)7-14-17(13)22(4)18(24)20-14;1-8-15(10(3)24-20-8)12-6-13(16-9(2)21-25-11(16)4)17-14(7-12)19-18(23)22(17)5;1-8-7-18-22(4)16(8)12-5-11(14-9(2)21-24-10(14)3)6-13-15(12)20-17(23)19-13;1-7-14(9(3)23-20-7)11-5-12(15-8(2)21-24-10(15)4)16-13(6-11)18-17(22)19-16;1-7-14(9(3)23-19-7)11-5-12(15-8(2)20-24-10(15)4)16-13(6-11)18-17(21)22-16/h3-13H,1-2H3,(H2,25,26,28);5,7,9-10H,6,8H2,1-4H3,(H2,24,25,29);5-11H,1-4H3,(H,25,28);4-10H,1-3H3,(H2,24,25,27);4-10H,1-3H3,(H,24,26);6-8H,1-5H3,(H,20,24);6-7H,1-5H3,(H,19,23);5-7H,1-4H3,(H2,19,20,23);5-6H,1-4H3,(H2,18,19,22);5-6H,1-4H3,(H,18,21)
InChIKeyALIZKHHJGVYEOC-UHFFFAOYSA-N
MW3558.91 g/mol
LogP39.86
Rot. Bonds21

About 5,7-bis(3,5-dimethyl-1,2-oxazol-4-yl)-3H-1,3-benzoxazol-2-one;4,6-bis(3,5-dimethyl-1,2-oxazol-4-yl)-1,3-dihydrobenzimidazol-2-one;4,6-bis(3,5-dimethyl-1,2-oxazol-4-yl)-3-methyl-1H-benzimidazol-2-one;6-(3,5-dimethyl-1,2-oxazol-4-yl)-4-(1,4-dimethylpyrazol-5-yl)-1,3-dihydrobenzimidazol-2-one;6-(3,5-dimethyl-1,2-oxazol-4-yl)-4-(1,4-dimethylpyrazol-5-yl)-3-methyl-1H-benzimidazol-2-one;6-(3,5-dimethyl-1,2-oxazol-4-yl)-3-methyl-4-(6-methylquinolin-5-yl)-1H-benzimidazol-2-one;5-(3,5-dimethyl-1,2-oxazol-4-yl)-7-(6-methylquinolin-5-yl)-3H-1,3-benzoxazol-2-one;6-(3,5-dimethyl-1,2-oxazol-4-yl)-4-(6-methylquinolin-5-yl)-1,3-dihydrobenzimidazol-2-one;5-[6-(3,5-dimethyl-1,2-oxazol-4-yl)-2-oxo-1,3-dihydrobenzimidazol-4-yl]-1,6-dimethyl-3,4-dihydroquinolin-2-one;6-(3,5-dimethyl-1,2-oxazol-4-yl)-4-(2-phenylphenyl)-1,3-dihydrobenzimidazol-2-one

5,7-bis(3,5-dimethyl-1,2-oxazol-4-yl)-3H-1,3-benzoxazol-2-one;4,6-bis(3,5-dimethyl-1,2-oxazol-4-yl)-1,3-dihydrobenzimidazol-2-one;4,6-bis(3,5-dimethyl-1,2-oxazol-4-yl)-3-methyl-1H-benzimidazol-2-one;6-(3,5-dimethyl-1,2-oxazol-4-yl)-4-(1,4-dimethylpyrazol-5-yl)-1,3-dihydrobenzimidazol-2-one;6-(3,5-dimethyl-1,2-oxazol-4-yl)-4-(1,4-dimethylpyrazol-5-yl)-3-methyl-1H-benzimidazol-2-one;6-(3,5-dimethyl-1,2-oxazol-4-yl)-3-methyl-4-(6-methylquinolin-5-yl)-1H-benzimidazol-2-one;5-(3,5-dimethyl-1,2-oxazol-4-yl)-7-(6-methylquinolin-5-yl)-3H-1,3-benzoxazol-2-one;6-(3,5-dimethyl-1,2-oxazol-4-yl)-4-(6-methylquinolin-5-yl)-1,3-dihydrobenzimidazol-2-one;5-[6-(3,5-dimethyl-1,2-oxazol-4-yl)-2-oxo-1,3-dihydrobenzimidazol-4-yl]-1,6-dimethyl-3,4-dihydroquinolin-2-one;6-(3,5-dimethyl-1,2-oxazol-4-yl)-4-(2-phenylphenyl)-1,3-dihydrobenzimidazol-2-one (PubChem CID 157151951) has the molecular formula C201H181N39O26 and a molecular weight of 3558.91 g/mol. Its IUPAC name is 5,7-bis(3,5-dimethyl-1,2-oxazol-4-yl)-3H-1,3-benzoxazol-2-one;4,6-bis(3,5-dimethyl-1,2-oxazol-4-yl)-1,3-dihydrobenzimidazol-2-one;4,6-bis(3,5-dimethyl-1,2-oxazol-4-yl)-3-methyl-1H-benzimidazol-2-one;6-(3,5-dimethyl-1,2-oxazol-4-yl)-4-(1,4-dimethylpyrazol-5-yl)-1,3-dihydrobenzimidazol-2-one;6-(3,5-dimethyl-1,2-oxazol-4-yl)-4-(1,4-dimethylpyrazol-5-yl)-3-methyl-1H-benzimidazol-2-one;6-(3,5-dimethyl-1,2-oxazol-4-yl)-3-methyl-4-(6-methylquinolin-5-yl)-1H-benzimidazol-2-one;5-(3,5-dimethyl-1,2-oxazol-4-yl)-7-(6-methylquinolin-5-yl)-3H-1,3-benzoxazol-2-one;6-(3,5-dimethyl-1,2-oxazol-4-yl)-4-(6-methylquinolin-5-yl)-1,3-dihydrobenzimidazol-2-one;5-[6-(3,5-dimethyl-1,2-oxazol-4-yl)-2-oxo-1,3-dihydrobenzimidazol-4-yl]-1,6-dimethyl-3,4-dihydroquinolin-2-one;6-(3,5-dimethyl-1,2-oxazol-4-yl)-4-(2-phenylphenyl)-1,3-dihydrobenzimidazol-2-one.

Molecular Properties

Compound Name5,7-bis(3,5-dimethyl-1,2-oxazol-4-yl)-3H-1,3-benzoxazol-2-one;4,6-bis(3,5-dimethyl-1,2-oxazol-4-yl)-1,3-dihydrobenzimidazol-2-one;4,6-bis(3,5-dimethyl-1,2-oxazol-4-yl)-3-methyl-1H-benzimidazol-2-one;6-(3,5-dimethyl-1,2-oxazol-4-yl)-4-(1,4-dimethylpyrazol-5-yl)-1,3-dihydrobenzimidazol-2-one;6-(3,5-dimethyl-1,2-oxazol-4-yl)-4-(1,4-dimethylpyrazol-5-yl)-3-methyl-1H-benzimidazol-2-one;6-(3,5-dimethyl-1,2-oxazol-4-yl)-3-methyl-4-(6-methylquinolin-5-yl)-1H-benzimidazol-2-one;5-(3,5-dimethyl-1,2-oxazol-4-yl)-7-(6-methylquinolin-5-yl)-3H-1,3-benzoxazol-2-one;6-(3,5-dimethyl-1,2-oxazol-4-yl)-4-(6-methylquinolin-5-yl)-1,3-dihydrobenzimidazol-2-one;5-[6-(3,5-dimethyl-1,2-oxazol-4-yl)-2-oxo-1,3-dihydrobenzimidazol-4-yl]-1,6-dimethyl-3,4-dihydroquinolin-2-one;6-(3,5-dimethyl-1,2-oxazol-4-yl)-4-(2-phenylphenyl)-1,3-dihydrobenzimidazol-2-one
PubChem CID157151951
Molecular FormulaC201H181N39O26
Molecular Weight3558.91 g/mol
Exact Mass3556.40
IUPAC Name5,7-bis(3,5-dimethyl-1,2-oxazol-4-yl)-3H-1,3-benzoxazol-2-one;4,6-bis(3,5-dimethyl-1,2-oxazol-4-yl)-1,3-dihydrobenzimidazol-2-one;4,6-bis(3,5-dimethyl-1,2-oxazol-4-yl)-3-methyl-1H-benzimidazol-2-one;6-(3,5-dimethyl-1,2-oxazol-4-yl)-4-(1,4-dimethylpyrazol-5-yl)-1,3-dihydrobenzimidazol-2-one;6-(3,5-dimethyl-1,2-oxazol-4-yl)-4-(1,4-dimethylpyrazol-5-yl)-3-methyl-1H-benzimidazol-2-one;6-(3,5-dimethyl-1,2-oxazol-4-yl)-3-methyl-4-(6-methylquinolin-5-yl)-1H-benzimidazol-2-one;5-(3,5-dimethyl-1,2-oxazol-4-yl)-7-(6-methylquinolin-5-yl)-3H-1,3-benzoxazol-2-one;6-(3,5-dimethyl-1,2-oxazol-4-yl)-4-(6-methylquinolin-5-yl)-1,3-dihydrobenzimidazol-2-one;5-[6-(3,5-dimethyl-1,2-oxazol-4-yl)-2-oxo-1,3-dihydrobenzimidazol-4-yl]-1,6-dimethyl-3,4-dihydroquinolin-2-one;6-(3,5-dimethyl-1,2-oxazol-4-yl)-4-(2-phenylphenyl)-1,3-dihydrobenzimidazol-2-one
SMILESCc1ccc2c(c1-c1cc(-c3c(C)noc3C)cc3[nH]c(=O)[nH]c13)CCC(=O)N2C.Cc1ccc2ncccc2c1-c1cc(-c2c(C)noc2C)cc2[nH]c(=O)[nH]c12.Cc1ccc2ncccc2c1-c1cc(-c2c(C)noc2C)cc2[nH]c(=O)n(C)c12.Cc1ccc2ncccc2c1-c1cc(-c2c(C)noc2C)cc2[nH]c(=O)oc12.Cc1cnn(C)c1-c1cc(-c2c(C)noc2C)cc2[nH]c(=O)[nH]c12.Cc1cnn(C)c1-c1cc(-c2c(C)noc2C)cc2[nH]c(=O)n(C)c12.Cc1noc(C)c1-c1cc(-c2c(C)noc2C)c2[nH]c(=O)[nH]c2c1.Cc1noc(C)c1-c1cc(-c2c(C)noc2C)c2c(c1)[nH]c(=O)n2C.Cc1noc(C)c1-c1cc(-c2c(C)noc2C)c2oc(=O)[nH]c2c1.Cc1noc(C)c1-c1cc(-c2ccccc2-c2ccccc2)c2[nH]c(=O)[nH]c2c1
InChIInChI=1S/C24H19N3O2.C23H22N4O3.C23H20N4O2.C22H18N4O2.C22H17N3O3.C18H19N5O2.C18H18N4O3.C17H17N5O2.C17H16N4O3.C17H15N3O4/c1-14-22(15(2)29-27-14)17-12-20(23-21(13-17)25-24(28)26-23)19-11-7-6-10-18(19)16-8-4-3-5-9-16;1-11-5-7-18-15(6-8-19(28)27(18)4)20(11)16-9-14(21-12(2)26-30-13(21)3)10-17-22(16)25-23(29)24-17;1-12-7-8-18-16(6-5-9-24-18)20(12)17-10-15(21-13(2)26-29-14(21)3)11-19-22(17)27(4)23(28)25-19;1-11-6-7-17-15(5-4-8-23-17)19(11)16-9-14(20-12(2)26-28-13(20)3)10-18-21(16)25-22(27)24-18;1-11-6-7-17-15(5-4-8-23-17)19(11)16-9-14(20-12(2)25-28-13(20)3)10-18-21(16)27-22(26)24-18;1-9-8-19-23(5)16(9)13-6-12(15-10(2)21-25-11(15)3)7-14-17(13)22(4)18(24)20-14;1-8-15(10(3)24-20-8)12-6-13(16-9(2)21-25-11(16)4)17-14(7-12)19-18(23)22(17)5;1-8-7-18-22(4)16(8)12-5-11(14-9(2)21-24-10(14)3)6-13-15(12)20-17(23)19-13;1-7-14(9(3)23-20-7)11-5-12(15-8(2)21-24-10(15)4)16-13(6-11)18-17(22)19-16;1-7-14(9(3)23-19-7)11-5-12(15-8(2)20-24-10(15)4)16-13(6-11)18-17(21)22-16/h3-13H,1-2H3,(H2,25,26,28);5,7,9-10H,6,8H2,1-4H3,(H2,24,25,29);5-11H,1-4H3,(H,25,28);4-10H,1-3H3,(H2,24,25,27);4-10H,1-3H3,(H,24,26);6-8H,1-5H3,(H,20,24);6-7H,1-5H3,(H,19,23);5-7H,1-4H3,(H2,19,20,23);5-6H,1-4H3,(H2,18,19,22);5-6H,1-4H3,(H,18,21)
InChIKeyALIZKHHJGVYEOC-UHFFFAOYSA-N
XLogP39.86
TPSA881.63 Ų
H-Bond Donors15
H-Bond Acceptors49
Rotatable Bonds21
Heavy Atoms266
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5003558.91
LogP ≤ 539.86
H-Bond Donors ≤ 515
H-Bond Acceptors ≤ 1049

Analyze 5,7-bis(3,5-dimethyl-1,2-oxazol-4-yl)-3H-1,3-benzoxazol-2-one;4,6-bis(3,5-dimethyl-1,2-oxazol-4-yl)-1,3-dihydrobenzimidazol-2-one;4,6-bis(3,5-dimethyl-1,2-oxazol-4-yl)-3-methyl-1H-benzimidazol-2-one;6-(3,5-dimethyl-1,2-oxazol-4-yl)-4-(1,4-dimethylpyrazol-5-yl)-1,3-dihydrobenzimidazol-2-one;6-(3,5-dimethyl-1,2-oxazol-4-yl)-4-(1,4-dimethylpyrazol-5-yl)-3-methyl-1H-benzimidazol-2-one;6-(3,5-dimethyl-1,2-oxazol-4-yl)-3-methyl-4-(6-methylquinolin-5-yl)-1H-benzimidazol-2-one;5-(3,5-dimethyl-1,2-oxazol-4-yl)-7-(6-methylquinolin-5-yl)-3H-1,3-benzoxazol-2-one;6-(3,5-dimethyl-1,2-oxazol-4-yl)-4-(6-methylquinolin-5-yl)-1,3-dihydrobenzimidazol-2-one;5-[6-(3,5-dimethyl-1,2-oxazol-4-yl)-2-oxo-1,3-dihydrobenzimidazol-4-yl]-1,6-dimethyl-3,4-dihydroquinolin-2-one;6-(3,5-dimethyl-1,2-oxazol-4-yl)-4-(2-phenylphenyl)-1,3-dihydrobenzimidazol-2-one with MolForge

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Launch Full Analysis

Related Compounds

6-(3,5-dimethyl-1,2-oxazol-4-yl)-4-iodo-1,3-dihydrobenzimidazol-2-one;6-(3,5-dimethyl-1,2-oxazol-4-yl)-4-(2-methylnaphthalen-1-yl)-1,3-dihydrobenzimidazol-2-one;(2-methylnaphthalen-1-yl)boronic acid
CID 160745553
3,5-dimethyl-4-[2-methyl-7-(6-methylquinolin-5-yl)-3H-benzimidazol-5-yl]-1,2-oxazole;4-(7-iodo-2-methyl-3H-benzimidazol-5-yl)-3,5-dimethyl-1,2-oxazole
CID 159395312
4-[4-[6-(3,5-dimethyl-1,2-oxazol-4-yl)-3-methyl-2-oxo-1H-benzimidazol-4-yl]-3,5-dimethylpyrazol-1-yl]butanamide
CID 171638152
CID 159738279
CID 159738279
7-(3,5-dimethyl-1,2-oxazol-4-yl)-1-(2-methylphenyl)-3H-imidazo[4,5-c]quinolin-2-one
CID 52933810
1-methyl-8-quinolin-3-yl-3H-imidazo[4,5-c]quinolin-2-one
CID 69251341
4-[2-[4-(3,5-dimethyl-1,2-oxazol-4-yl)phenyl]phenyl]-3,5-dimethyl-1,2-oxazole
CID 91804006
3-amino-5,7-bis(3,5-dimethyl-1,2-oxazol-4-yl)-1H-benzimidazol-2-one
CID 126692116
3,5-dimethyl-4-[7-(2-methyl-3-pyridinyl)-1H-indazol-5-yl]-1,2-oxazole
CID 121293057
(5S)-5-[6-(3,5-dimethyl-1,2-oxazol-4-yl)-1H-benzimidazol-2-yl]-1-pyridin-3-ylpyrrolidin-2-one
CID 134457665
N-[6-(3,5-dimethyl-1,2-oxazol-4-yl)-4-(6-methylquinolin-5-yl)-2,3-dihydro-1H-benzimidazol-2-yl]-3,3,3-trifluoropropane-1-sulfonamide
CID 123335373
6-(3,5-dimethyl-1,2-oxazol-4-yl)-N-phenylquinazolin-4-amine
CID 3234707

Frequently Asked Questions

What is the IUPAC name of 5,7-bis(3,5-dimethyl-1,2-oxazol-4-yl)-3H-1,3-benzoxazol-2-one;4,6-bis(3,5-dimethyl-1,2-oxazol-4-yl)-1,3-dihydrobenzimidazol-2-one;4,6-bis(3,5-dimethyl-1,2-oxazol-4-yl)-3-methyl-1H-benzimidazol-2-one;6-(3,5-dimethyl-1,2-oxazol-4-yl)-4-(1,4-dimethylpyrazol-5-yl)-1,3-dihydrobenzimidazol-2-one;6-(3,5-dimethyl-1,2-oxazol-4-yl)-4-(1,4-dimethylpyrazol-5-yl)-3-methyl-1H-benzimidazol-2-one;6-(3,5-dimethyl-1,2-oxazol-4-yl)-3-methyl-4-(6-methylquinolin-5-yl)-1H-benzimidazol-2-one;5-(3,5-dimethyl-1,2-oxazol-4-yl)-7-(6-methylquinolin-5-yl)-3H-1,3-benzoxazol-2-one;6-(3,5-dimethyl-1,2-oxazol-4-yl)-4-(6-methylquinolin-5-yl)-1,3-dihydrobenzimidazol-2-one;5-[6-(3,5-dimethyl-1,2-oxazol-4-yl)-2-oxo-1,3-dihydrobenzimidazol-4-yl]-1,6-dimethyl-3,4-dihydroquinolin-2-one;6-(3,5-dimethyl-1,2-oxazol-4-yl)-4-(2-phenylphenyl)-1,3-dihydrobenzimidazol-2-one?
The IUPAC name of 5,7-bis(3,5-dimethyl-1,2-oxazol-4-yl)-3H-1,3-benzoxazol-2-one;4,6-bis(3,5-dimethyl-1,2-oxazol-4-yl)-1,3-dihydrobenzimidazol-2-one;4,6-bis(3,5-dimethyl-1,2-oxazol-4-yl)-3-methyl-1H-benzimidazol-2-one;6-(3,5-dimethyl-1,2-oxazol-4-yl)-4-(1,4-dimethylpyrazol-5-yl)-1,3-dihydrobenzimidazol-2-one;6-(3,5-dimethyl-1,2-oxazol-4-yl)-4-(1,4-dimethylpyrazol-5-yl)-3-methyl-1H-benzimidazol-2-one;6-(3,5-dimethyl-1,2-oxazol-4-yl)-3-methyl-4-(6-methylquinolin-5-yl)-1H-benzimidazol-2-one;5-(3,5-dimethyl-1,2-oxazol-4-yl)-7-(6-methylquinolin-5-yl)-3H-1,3-benzoxazol-2-one;6-(3,5-dimethyl-1,2-oxazol-4-yl)-4-(6-methylquinolin-5-yl)-1,3-dihydrobenzimidazol-2-one;5-[6-(3,5-dimethyl-1,2-oxazol-4-yl)-2-oxo-1,3-dihydrobenzimidazol-4-yl]-1,6-dimethyl-3,4-dihydroquinolin-2-one;6-(3,5-dimethyl-1,2-oxazol-4-yl)-4-(2-phenylphenyl)-1,3-dihydrobenzimidazol-2-one (CID 157151951) is 5,7-bis(3,5-dimethyl-1,2-oxazol-4-yl)-3H-1,3-benzoxazol-2-one;4,6-bis(3,5-dimethyl-1,2-oxazol-4-yl)-1,3-dihydrobenzimidazol-2-one;4,6-bis(3,5-dimethyl-1,2-oxazol-4-yl)-3-methyl-1H-benzimidazol-2-one;6-(3,5-dimethyl-1,2-oxazol-4-yl)-4-(1,4-dimethylpyrazol-5-yl)-1,3-dihydrobenzimidazol-2-one;6-(3,5-dimethyl-1,2-oxazol-4-yl)-4-(1,4-dimethylpyrazol-5-yl)-3-methyl-1H-benzimidazol-2-one;6-(3,5-dimethyl-1,2-oxazol-4-yl)-3-methyl-4-(6-methylquinolin-5-yl)-1H-benzimidazol-2-one;5-(3,5-dimethyl-1,2-oxazol-4-yl)-7-(6-methylquinolin-5-yl)-3H-1,3-benzoxazol-2-one;6-(3,5-dimethyl-1,2-oxazol-4-yl)-4-(6-methylquinolin-5-yl)-1,3-dihydrobenzimidazol-2-one;5-[6-(3,5-dimethyl-1,2-oxazol-4-yl)-2-oxo-1,3-dihydrobenzimidazol-4-yl]-1,6-dimethyl-3,4-dihydroquinolin-2-one;6-(3,5-dimethyl-1,2-oxazol-4-yl)-4-(2-phenylphenyl)-1,3-dihydrobenzimidazol-2-one.
What is the SMILES notation for 5,7-bis(3,5-dimethyl-1,2-oxazol-4-yl)-3H-1,3-benzoxazol-2-one;4,6-bis(3,5-dimethyl-1,2-oxazol-4-yl)-1,3-dihydrobenzimidazol-2-one;4,6-bis(3,5-dimethyl-1,2-oxazol-4-yl)-3-methyl-1H-benzimidazol-2-one;6-(3,5-dimethyl-1,2-oxazol-4-yl)-4-(1,4-dimethylpyrazol-5-yl)-1,3-dihydrobenzimidazol-2-one;6-(3,5-dimethyl-1,2-oxazol-4-yl)-4-(1,4-dimethylpyrazol-5-yl)-3-methyl-1H-benzimidazol-2-one;6-(3,5-dimethyl-1,2-oxazol-4-yl)-3-methyl-4-(6-methylquinolin-5-yl)-1H-benzimidazol-2-one;5-(3,5-dimethyl-1,2-oxazol-4-yl)-7-(6-methylquinolin-5-yl)-3H-1,3-benzoxazol-2-one;6-(3,5-dimethyl-1,2-oxazol-4-yl)-4-(6-methylquinolin-5-yl)-1,3-dihydrobenzimidazol-2-one;5-[6-(3,5-dimethyl-1,2-oxazol-4-yl)-2-oxo-1,3-dihydrobenzimidazol-4-yl]-1,6-dimethyl-3,4-dihydroquinolin-2-one;6-(3,5-dimethyl-1,2-oxazol-4-yl)-4-(2-phenylphenyl)-1,3-dihydrobenzimidazol-2-one?
The canonical SMILES for 5,7-bis(3,5-dimethyl-1,2-oxazol-4-yl)-3H-1,3-benzoxazol-2-one;4,6-bis(3,5-dimethyl-1,2-oxazol-4-yl)-1,3-dihydrobenzimidazol-2-one;4,6-bis(3,5-dimethyl-1,2-oxazol-4-yl)-3-methyl-1H-benzimidazol-2-one;6-(3,5-dimethyl-1,2-oxazol-4-yl)-4-(1,4-dimethylpyrazol-5-yl)-1,3-dihydrobenzimidazol-2-one;6-(3,5-dimethyl-1,2-oxazol-4-yl)-4-(1,4-dimethylpyrazol-5-yl)-3-methyl-1H-benzimidazol-2-one;6-(3,5-dimethyl-1,2-oxazol-4-yl)-3-methyl-4-(6-methylquinolin-5-yl)-1H-benzimidazol-2-one;5-(3,5-dimethyl-1,2-oxazol-4-yl)-7-(6-methylquinolin-5-yl)-3H-1,3-benzoxazol-2-one;6-(3,5-dimethyl-1,2-oxazol-4-yl)-4-(6-methylquinolin-5-yl)-1,3-dihydrobenzimidazol-2-one;5-[6-(3,5-dimethyl-1,2-oxazol-4-yl)-2-oxo-1,3-dihydrobenzimidazol-4-yl]-1,6-dimethyl-3,4-dihydroquinolin-2-one;6-(3,5-dimethyl-1,2-oxazol-4-yl)-4-(2-phenylphenyl)-1,3-dihydrobenzimidazol-2-one is Cc1ccc2c(c1-c1cc(-c3c(C)noc3C)cc3[nH]c(=O)[nH]c13)CCC(=O)N2C.Cc1ccc2ncccc2c1-c1cc(-c2c(C)noc2C)cc2[nH]c(=O)[nH]c12.Cc1ccc2ncccc2c1-c1cc(-c2c(C)noc2C)cc2[nH]c(=O)n(C)c12.Cc1ccc2ncccc2c1-c1cc(-c2c(C)noc2C)cc2[nH]c(=O)oc12.Cc1cnn(C)c1-c1cc(-c2c(C)noc2C)cc2[nH]c(=O)[nH]c12.Cc1cnn(C)c1-c1cc(-c2c(C)noc2C)cc2[nH]c(=O)n(C)c12.Cc1noc(C)c1-c1cc(-c2c(C)noc2C)c2[nH]c(=O)[nH]c2c1.Cc1noc(C)c1-c1cc(-c2c(C)noc2C)c2c(c1)[nH]c(=O)n2C.Cc1noc(C)c1-c1cc(-c2c(C)noc2C)c2oc(=O)[nH]c2c1.Cc1noc(C)c1-c1cc(-c2ccccc2-c2ccccc2)c2[nH]c(=O)[nH]c2c1.
What is the InChIKey of 5,7-bis(3,5-dimethyl-1,2-oxazol-4-yl)-3H-1,3-benzoxazol-2-one;4,6-bis(3,5-dimethyl-1,2-oxazol-4-yl)-1,3-dihydrobenzimidazol-2-one;4,6-bis(3,5-dimethyl-1,2-oxazol-4-yl)-3-methyl-1H-benzimidazol-2-one;6-(3,5-dimethyl-1,2-oxazol-4-yl)-4-(1,4-dimethylpyrazol-5-yl)-1,3-dihydrobenzimidazol-2-one;6-(3,5-dimethyl-1,2-oxazol-4-yl)-4-(1,4-dimethylpyrazol-5-yl)-3-methyl-1H-benzimidazol-2-one;6-(3,5-dimethyl-1,2-oxazol-4-yl)-3-methyl-4-(6-methylquinolin-5-yl)-1H-benzimidazol-2-one;5-(3,5-dimethyl-1,2-oxazol-4-yl)-7-(6-methylquinolin-5-yl)-3H-1,3-benzoxazol-2-one;6-(3,5-dimethyl-1,2-oxazol-4-yl)-4-(6-methylquinolin-5-yl)-1,3-dihydrobenzimidazol-2-one;5-[6-(3,5-dimethyl-1,2-oxazol-4-yl)-2-oxo-1,3-dihydrobenzimidazol-4-yl]-1,6-dimethyl-3,4-dihydroquinolin-2-one;6-(3,5-dimethyl-1,2-oxazol-4-yl)-4-(2-phenylphenyl)-1,3-dihydrobenzimidazol-2-one?
The InChIKey is ALIZKHHJGVYEOC-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H19N3O2.C23H22N4O3.C23H20N4O2.C22H18N4O2.C22H17N3O3.C18H19N5O2.C18H18N4O3.C17H17N5O2.C17H16N4O3.C17H15N3O4/c1-14-22(15(2)29-27-14)17-12-20(23-21(13-17)25-24(28)26-23)19-11-7-6-10-18(19)16-8-4-3-5-9-16;1-11-5-7-18-15(6-8-19(28)27(18)4)20(11)16-9-14(21-12(2)26-30-13(21)3)10-17-22(16)25-23(29)24-17;1-12-7-8-18-16(6-5-9-24-18)20(12)17-10-15(21-13(2)26-29-14(21)3)11-19-22(17)27(4)23(28)25-19;1-11-6-7-17-15(5-4-8-23-17)19(11)16-9-14(20-12(2)26-28-13(20)3)10-18-21(16)25-22(27)24-18;1-11-6-7-17-15(5-4-8-23-17)19(11)16-9-14(20-12(2)25-28-13(20)3)10-18-21(16)27-22(26)24-18;1-9-8-19-23(5)16(9)13-6-12(15-10(2)21-25-11(15)3)7-14-17(13)22(4)18(24)20-14;1-8-15(10(3)24-20-8)12-6-13(16-9(2)21-25-11(16)4)17-14(7-12)19-18(23)22(17)5;1-8-7-18-22(4)16(8)12-5-11(14-9(2)21-24-10(14)3)6-13-15(12)20-17(23)19-13;1-7-14(9(3)23-20-7)11-5-12(15-8(2)21-24-10(15)4)16-13(6-11)18-17(22)19-16;1-7-14(9(3)23-19-7)11-5-12(15-8(2)20-24-10(15)4)16-13(6-11)18-17(21)22-16/h3-13H,1-2H3,(H2,25,26,28);5,7,9-10H,6,8H2,1-4H3,(H2,24,25,29);5-11H,1-4H3,(H,25,28);4-10H,1-3H3,(H2,24,25,27);4-10H,1-3H3,(H,24,26);6-8H,1-5H3,(H,20,24);6-7H,1-5H3,(H,19,23);5-7H,1-4H3,(H2,19,20,23);5-6H,1-4H3,(H2,18,19,22);5-6H,1-4H3,(H,18,21).
What are the key properties of 5,7-bis(3,5-dimethyl-1,2-oxazol-4-yl)-3H-1,3-benzoxazol-2-one;4,6-bis(3,5-dimethyl-1,2-oxazol-4-yl)-1,3-dihydrobenzimidazol-2-one;4,6-bis(3,5-dimethyl-1,2-oxazol-4-yl)-3-methyl-1H-benzimidazol-2-one;6-(3,5-dimethyl-1,2-oxazol-4-yl)-4-(1,4-dimethylpyrazol-5-yl)-1,3-dihydrobenzimidazol-2-one;6-(3,5-dimethyl-1,2-oxazol-4-yl)-4-(1,4-dimethylpyrazol-5-yl)-3-methyl-1H-benzimidazol-2-one;6-(3,5-dimethyl-1,2-oxazol-4-yl)-3-methyl-4-(6-methylquinolin-5-yl)-1H-benzimidazol-2-one;5-(3,5-dimethyl-1,2-oxazol-4-yl)-7-(6-methylquinolin-5-yl)-3H-1,3-benzoxazol-2-one;6-(3,5-dimethyl-1,2-oxazol-4-yl)-4-(6-methylquinolin-5-yl)-1,3-dihydrobenzimidazol-2-one;5-[6-(3,5-dimethyl-1,2-oxazol-4-yl)-2-oxo-1,3-dihydrobenzimidazol-4-yl]-1,6-dimethyl-3,4-dihydroquinolin-2-one;6-(3,5-dimethyl-1,2-oxazol-4-yl)-4-(2-phenylphenyl)-1,3-dihydrobenzimidazol-2-one?
5,7-bis(3,5-dimethyl-1,2-oxazol-4-yl)-3H-1,3-benzoxazol-2-one;4,6-bis(3,5-dimethyl-1,2-oxazol-4-yl)-1,3-dihydrobenzimidazol-2-one;4,6-bis(3,5-dimethyl-1,2-oxazol-4-yl)-3-methyl-1H-benzimidazol-2-one;6-(3,5-dimethyl-1,2-oxazol-4-yl)-4-(1,4-dimethylpyrazol-5-yl)-1,3-dihydrobenzimidazol-2-one;6-(3,5-dimethyl-1,2-oxazol-4-yl)-4-(1,4-dimethylpyrazol-5-yl)-3-methyl-1H-benzimidazol-2-one;6-(3,5-dimethyl-1,2-oxazol-4-yl)-3-methyl-4-(6-methylquinolin-5-yl)-1H-benzimidazol-2-one;5-(3,5-dimethyl-1,2-oxazol-4-yl)-7-(6-methylquinolin-5-yl)-3H-1,3-benzoxazol-2-one;6-(3,5-dimethyl-1,2-oxazol-4-yl)-4-(6-methylquinolin-5-yl)-1,3-dihydrobenzimidazol-2-one;5-[6-(3,5-dimethyl-1,2-oxazol-4-yl)-2-oxo-1,3-dihydrobenzimidazol-4-yl]-1,6-dimethyl-3,4-dihydroquinolin-2-one;6-(3,5-dimethyl-1,2-oxazol-4-yl)-4-(2-phenylphenyl)-1,3-dihydrobenzimidazol-2-one has a molecular weight of 3558.91 g/mol, XLogP of 39.86, 21 rotatable bonds, 15 hydrogen bond donors, and 49 hydrogen bond acceptors.
Where does this data come from?
All data for 5,7-bis(3,5-dimethyl-1,2-oxazol-4-yl)-3H-1,3-benzoxazol-2-one;4,6-bis(3,5-dimethyl-1,2-oxazol-4-yl)-1,3-dihydrobenzimidazol-2-one;4,6-bis(3,5-dimethyl-1,2-oxazol-4-yl)-3-methyl-1H-benzimidazol-2-one;6-(3,5-dimethyl-1,2-oxazol-4-yl)-4-(1,4-dimethylpyrazol-5-yl)-1,3-dihydrobenzimidazol-2-one;6-(3,5-dimethyl-1,2-oxazol-4-yl)-4-(1,4-dimethylpyrazol-5-yl)-3-methyl-1H-benzimidazol-2-one;6-(3,5-dimethyl-1,2-oxazol-4-yl)-3-methyl-4-(6-methylquinolin-5-yl)-1H-benzimidazol-2-one;5-(3,5-dimethyl-1,2-oxazol-4-yl)-7-(6-methylquinolin-5-yl)-3H-1,3-benzoxazol-2-one;6-(3,5-dimethyl-1,2-oxazol-4-yl)-4-(6-methylquinolin-5-yl)-1,3-dihydrobenzimidazol-2-one;5-[6-(3,5-dimethyl-1,2-oxazol-4-yl)-2-oxo-1,3-dihydrobenzimidazol-4-yl]-1,6-dimethyl-3,4-dihydroquinolin-2-one;6-(3,5-dimethyl-1,2-oxazol-4-yl)-4-(2-phenylphenyl)-1,3-dihydrobenzimidazol-2-one is sourced from PubChem (CID 157151951), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).