1-(3-aminopropyl)-N-(5-cyclopenta-1,4-dien-1-yl-1,3,4-thiadiazol-2-yl)-2-methylbenzimidazole-5-carboxamide;1-(3-aminopropyl)-2-ethyl-N-[3-(furan-2-yl)-1,2,4-thiadiazol-5-yl]benzimidazole-5-carboxamide;1-(3-aminopropyl)-2-ethyl-N-[5-(furan-3-yl)-1,3,4-thiadiazol-2-yl]benzimidazole-5-carboxamide;1-(3-aminopropyl)-N-[6-(furan-2-yl)pyridazin-3-yl]benzimidazole-5-carboxamide;1-(3-aminopropyl)-N-[6-(furan-2-yl)pyridazin-3-yl]-2-methylbenzimidazole-5-carboxamide;1-(3-aminopropyl)-N-[3-(furan-2-yl)-1,2,4-thiadiazol-5-yl]-2-methylbenzimidazole-5-carboxamide;1-(3-aminopropyl)-N-[5-(furan-2-yl)-1,3,4-thiadiazol-2-yl]-2-methylbenzimidazole-5-carboxamide;1-(3-aminopropyl)-N-[4-(furan-2-yl)-1,3-thiazol-2-yl]-2-methylbenzimidazole-5-carboxamide

C151H153N47O15S6 — CID 159170515

IUPAC1-(3-aminopropyl)-N-(5-cyclopenta-1,4-dien-1-yl-1,3,4-thiadiazol-2-yl)-2-methylbenzimidazole-5-carboxamide;1-(3-aminopropyl)-2-ethyl-N-[3-(furan-2-yl)-1,2,4-thiadiazol-5-yl]benzimidazole-5-carboxamide;1-(3-aminopropyl)-2-ethyl-N-[5-(furan-3-yl)-1,3,4-thiadiazol-2-yl]benzimidazole-5-carboxamide;1-(3-aminopropyl)-N-[6-(furan-2-yl)pyridazin-3-yl]benzimidazole-5-carboxamide;1-(3-aminopropyl)-N-[6-(furan-2-yl)pyridazin-3-yl]-2-methylbenzimidazole-5-carboxamide;1-(3-aminopropyl)-N-[3-(furan-2-yl)-1,2,4-thiadiazol-5-yl]-2-methylbenzimidazole-5-carboxamide;1-(3-aminopropyl)-N-[5-(furan-2-yl)-1,3,4-thiadiazol-2-yl]-2-methylbenzimidazole-5-carboxamide;1-(3-aminopropyl)-N-[4-(furan-2-yl)-1,3-thiazol-2-yl]-2-methylbenzimidazole-5-carboxamide
SMILESCCc1nc2cc(C(=O)Nc3nc(-c4ccco4)ns3)ccc2n1CCCN.CCc1nc2cc(C(=O)Nc3nnc(-c4ccoc4)s3)ccc2n1CCCN.Cc1nc2cc(C(=O)Nc3ccc(-c4ccco4)nn3)ccc2n1CCCN.Cc1nc2cc(C(=O)Nc3nc(-c4ccco4)cs3)ccc2n1CCCN.Cc1nc2cc(C(=O)Nc3nc(-c4ccco4)ns3)ccc2n1CCCN.Cc1nc2cc(C(=O)Nc3nnc(-c4ccco4)s3)ccc2n1CCCN.Cc1nc2cc(C(=O)Nc3nnc(C4=CCC=C4)s3)ccc2n1CCCN.NCCCn1cnc2cc(C(=O)Nc3ccc(-c4ccco4)nn3)ccc21
InChIInChI=1S/C20H20N6O2.2C19H20N6O2S.C19H18N6O2.C19H20N6OS.C19H19N5O2S.2C18H18N6O2S/c1-13-22-16-12-14(5-7-17(16)26(13)10-3-9-21)20(27)23-19-8-6-15(24-25-19)18-4-2-11-28-18;1-2-16-21-14-10-12(4-5-15(14)25(16)8-3-7-20)17(26)22-19-24-23-18(28-19)13-6-9-27-11-13;1-2-16-21-13-11-12(6-7-14(13)25(16)9-4-8-20)18(26)23-19-22-17(24-28-19)15-5-3-10-27-15;20-8-2-9-25-12-21-15-11-13(4-6-16(15)25)19(26)22-18-7-5-14(23-24-18)17-3-1-10-27-17;1-12-21-15-11-14(7-8-16(15)25(12)10-4-9-20)17(26)22-19-24-23-18(27-19)13-5-2-3-6-13;1-12-21-14-10-13(5-6-16(14)24(12)8-3-7-20)18(25)23-19-22-15(11-27-19)17-4-2-9-26-17;1-11-20-13-10-12(5-6-14(13)24(11)8-3-7-19)17(25)22-18-21-16(23-27-18)15-4-2-9-26-15;1-11-20-13-10-12(5-6-14(13)24(11)8-3-7-19)16(25)21-18-23-22-17(27-18)15-4-2-9-26-15/h2,4-8,11-12H,3,9-10,21H2,1H3,(H,23,25,27);4-6,9-11H,2-3,7-8,20H2,1H3,(H,22,24,26);3,5-7,10-11H,2,4,8-9,20H2,1H3,(H,22,23,24,26);1,3-7,10-12H,2,8-9,20H2,(H,22,24,26);2,5-8,11H,3-4,9-10,20H2,1H3,(H,22,24,26);2,4-6,9-11H,3,7-8,20H2,1H3,(H,22,23,25);2,4-6,9-10H,3,7-8,19H2,1H3,(H,21,22,23,25);2,4-6,9-10H,3,7-8,19H2,1H3,(H,21,23,25)
InChIKeyKLPZFAAMMTUZIU-UHFFFAOYSA-N
MW3058.60 g/mol
LogP25.22
Rot. Bonds50

About 1-(3-aminopropyl)-N-(5-cyclopenta-1,4-dien-1-yl-1,3,4-thiadiazol-2-yl)-2-methylbenzimidazole-5-carboxamide;1-(3-aminopropyl)-2-ethyl-N-[3-(furan-2-yl)-1,2,4-thiadiazol-5-yl]benzimidazole-5-carboxamide;1-(3-aminopropyl)-2-ethyl-N-[5-(furan-3-yl)-1,3,4-thiadiazol-2-yl]benzimidazole-5-carboxamide;1-(3-aminopropyl)-N-[6-(furan-2-yl)pyridazin-3-yl]benzimidazole-5-carboxamide;1-(3-aminopropyl)-N-[6-(furan-2-yl)pyridazin-3-yl]-2-methylbenzimidazole-5-carboxamide;1-(3-aminopropyl)-N-[3-(furan-2-yl)-1,2,4-thiadiazol-5-yl]-2-methylbenzimidazole-5-carboxamide;1-(3-aminopropyl)-N-[5-(furan-2-yl)-1,3,4-thiadiazol-2-yl]-2-methylbenzimidazole-5-carboxamide;1-(3-aminopropyl)-N-[4-(furan-2-yl)-1,3-thiazol-2-yl]-2-methylbenzimidazole-5-carboxamide

1-(3-aminopropyl)-N-(5-cyclopenta-1,4-dien-1-yl-1,3,4-thiadiazol-2-yl)-2-methylbenzimidazole-5-carboxamide;1-(3-aminopropyl)-2-ethyl-N-[3-(furan-2-yl)-1,2,4-thiadiazol-5-yl]benzimidazole-5-carboxamide;1-(3-aminopropyl)-2-ethyl-N-[5-(furan-3-yl)-1,3,4-thiadiazol-2-yl]benzimidazole-5-carboxamide;1-(3-aminopropyl)-N-[6-(furan-2-yl)pyridazin-3-yl]benzimidazole-5-carboxamide;1-(3-aminopropyl)-N-[6-(furan-2-yl)pyridazin-3-yl]-2-methylbenzimidazole-5-carboxamide;1-(3-aminopropyl)-N-[3-(furan-2-yl)-1,2,4-thiadiazol-5-yl]-2-methylbenzimidazole-5-carboxamide;1-(3-aminopropyl)-N-[5-(furan-2-yl)-1,3,4-thiadiazol-2-yl]-2-methylbenzimidazole-5-carboxamide;1-(3-aminopropyl)-N-[4-(furan-2-yl)-1,3-thiazol-2-yl]-2-methylbenzimidazole-5-carboxamide (PubChem CID 159170515) has the molecular formula C151H153N47O15S6 and a molecular weight of 3058.60 g/mol. Its IUPAC name is 1-(3-aminopropyl)-N-(5-cyclopenta-1,4-dien-1-yl-1,3,4-thiadiazol-2-yl)-2-methylbenzimidazole-5-carboxamide;1-(3-aminopropyl)-2-ethyl-N-[3-(furan-2-yl)-1,2,4-thiadiazol-5-yl]benzimidazole-5-carboxamide;1-(3-aminopropyl)-2-ethyl-N-[5-(furan-3-yl)-1,3,4-thiadiazol-2-yl]benzimidazole-5-carboxamide;1-(3-aminopropyl)-N-[6-(furan-2-yl)pyridazin-3-yl]benzimidazole-5-carboxamide;1-(3-aminopropyl)-N-[6-(furan-2-yl)pyridazin-3-yl]-2-methylbenzimidazole-5-carboxamide;1-(3-aminopropyl)-N-[3-(furan-2-yl)-1,2,4-thiadiazol-5-yl]-2-methylbenzimidazole-5-carboxamide;1-(3-aminopropyl)-N-[5-(furan-2-yl)-1,3,4-thiadiazol-2-yl]-2-methylbenzimidazole-5-carboxamide;1-(3-aminopropyl)-N-[4-(furan-2-yl)-1,3-thiazol-2-yl]-2-methylbenzimidazole-5-carboxamide.

Molecular Properties

Compound Name1-(3-aminopropyl)-N-(5-cyclopenta-1,4-dien-1-yl-1,3,4-thiadiazol-2-yl)-2-methylbenzimidazole-5-carboxamide;1-(3-aminopropyl)-2-ethyl-N-[3-(furan-2-yl)-1,2,4-thiadiazol-5-yl]benzimidazole-5-carboxamide;1-(3-aminopropyl)-2-ethyl-N-[5-(furan-3-yl)-1,3,4-thiadiazol-2-yl]benzimidazole-5-carboxamide;1-(3-aminopropyl)-N-[6-(furan-2-yl)pyridazin-3-yl]benzimidazole-5-carboxamide;1-(3-aminopropyl)-N-[6-(furan-2-yl)pyridazin-3-yl]-2-methylbenzimidazole-5-carboxamide;1-(3-aminopropyl)-N-[3-(furan-2-yl)-1,2,4-thiadiazol-5-yl]-2-methylbenzimidazole-5-carboxamide;1-(3-aminopropyl)-N-[5-(furan-2-yl)-1,3,4-thiadiazol-2-yl]-2-methylbenzimidazole-5-carboxamide;1-(3-aminopropyl)-N-[4-(furan-2-yl)-1,3-thiazol-2-yl]-2-methylbenzimidazole-5-carboxamide
PubChem CID159170515
Molecular FormulaC151H153N47O15S6
Molecular Weight3058.60 g/mol
Exact Mass3056.10
IUPAC Name1-(3-aminopropyl)-N-(5-cyclopenta-1,4-dien-1-yl-1,3,4-thiadiazol-2-yl)-2-methylbenzimidazole-5-carboxamide;1-(3-aminopropyl)-2-ethyl-N-[3-(furan-2-yl)-1,2,4-thiadiazol-5-yl]benzimidazole-5-carboxamide;1-(3-aminopropyl)-2-ethyl-N-[5-(furan-3-yl)-1,3,4-thiadiazol-2-yl]benzimidazole-5-carboxamide;1-(3-aminopropyl)-N-[6-(furan-2-yl)pyridazin-3-yl]benzimidazole-5-carboxamide;1-(3-aminopropyl)-N-[6-(furan-2-yl)pyridazin-3-yl]-2-methylbenzimidazole-5-carboxamide;1-(3-aminopropyl)-N-[3-(furan-2-yl)-1,2,4-thiadiazol-5-yl]-2-methylbenzimidazole-5-carboxamide;1-(3-aminopropyl)-N-[5-(furan-2-yl)-1,3,4-thiadiazol-2-yl]-2-methylbenzimidazole-5-carboxamide;1-(3-aminopropyl)-N-[4-(furan-2-yl)-1,3-thiazol-2-yl]-2-methylbenzimidazole-5-carboxamide
SMILESCCc1nc2cc(C(=O)Nc3nc(-c4ccco4)ns3)ccc2n1CCCN.CCc1nc2cc(C(=O)Nc3nnc(-c4ccoc4)s3)ccc2n1CCCN.Cc1nc2cc(C(=O)Nc3ccc(-c4ccco4)nn3)ccc2n1CCCN.Cc1nc2cc(C(=O)Nc3nc(-c4ccco4)cs3)ccc2n1CCCN.Cc1nc2cc(C(=O)Nc3nc(-c4ccco4)ns3)ccc2n1CCCN.Cc1nc2cc(C(=O)Nc3nnc(-c4ccco4)s3)ccc2n1CCCN.Cc1nc2cc(C(=O)Nc3nnc(C4=CCC=C4)s3)ccc2n1CCCN.NCCCn1cnc2cc(C(=O)Nc3ccc(-c4ccco4)nn3)ccc21
InChIInChI=1S/C20H20N6O2.2C19H20N6O2S.C19H18N6O2.C19H20N6OS.C19H19N5O2S.2C18H18N6O2S/c1-13-22-16-12-14(5-7-17(16)26(13)10-3-9-21)20(27)23-19-8-6-15(24-25-19)18-4-2-11-28-18;1-2-16-21-14-10-12(4-5-15(14)25(16)8-3-7-20)17(26)22-19-24-23-18(28-19)13-6-9-27-11-13;1-2-16-21-13-11-12(6-7-14(13)25(16)9-4-8-20)18(26)23-19-22-17(24-28-19)15-5-3-10-27-15;20-8-2-9-25-12-21-15-11-13(4-6-16(15)25)19(26)22-18-7-5-14(23-24-18)17-3-1-10-27-17;1-12-21-15-11-14(7-8-16(15)25(12)10-4-9-20)17(26)22-19-24-23-18(27-19)13-5-2-3-6-13;1-12-21-14-10-13(5-6-16(14)24(12)8-3-7-20)18(25)23-19-22-15(11-27-19)17-4-2-9-26-17;1-11-20-13-10-12(5-6-14(13)24(11)8-3-7-19)17(25)22-18-21-16(23-27-18)15-4-2-9-26-15;1-11-20-13-10-12(5-6-14(13)24(11)8-3-7-19)16(25)21-18-23-22-17(27-18)15-4-2-9-26-15/h2,4-8,11-12H,3,9-10,21H2,1H3,(H,23,25,27);4-6,9-11H,2-3,7-8,20H2,1H3,(H,22,24,26);3,5-7,10-11H,2,4,8-9,20H2,1H3,(H,22,23,24,26);1,3-7,10-12H,2,8-9,20H2,(H,22,24,26);2,5-8,11H,3-4,9-10,20H2,1H3,(H,22,24,26);2,4-6,9-11H,3,7-8,20H2,1H3,(H,22,23,25);2,4-6,9-10H,3,7-8,19H2,1H3,(H,21,22,23,25);2,4-6,9-10H,3,7-8,19H2,1H3,(H,21,23,25)
InChIKeyKLPZFAAMMTUZIU-UHFFFAOYSA-N
XLogP25.22
TPSA868.85 Ų
H-Bond Donors16
H-Bond Acceptors60
Rotatable Bonds50
Heavy Atoms219
Complexity

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5003058.60
LogP ≤ 525.22
H-Bond Donors ≤ 516
H-Bond Acceptors ≤ 1060

Analyze 1-(3-aminopropyl)-N-(5-cyclopenta-1,4-dien-1-yl-1,3,4-thiadiazol-2-yl)-2-methylbenzimidazole-5-carboxamide;1-(3-aminopropyl)-2-ethyl-N-[3-(furan-2-yl)-1,2,4-thiadiazol-5-yl]benzimidazole-5-carboxamide;1-(3-aminopropyl)-2-ethyl-N-[5-(furan-3-yl)-1,3,4-thiadiazol-2-yl]benzimidazole-5-carboxamide;1-(3-aminopropyl)-N-[6-(furan-2-yl)pyridazin-3-yl]benzimidazole-5-carboxamide;1-(3-aminopropyl)-N-[6-(furan-2-yl)pyridazin-3-yl]-2-methylbenzimidazole-5-carboxamide;1-(3-aminopropyl)-N-[3-(furan-2-yl)-1,2,4-thiadiazol-5-yl]-2-methylbenzimidazole-5-carboxamide;1-(3-aminopropyl)-N-[5-(furan-2-yl)-1,3,4-thiadiazol-2-yl]-2-methylbenzimidazole-5-carboxamide;1-(3-aminopropyl)-N-[4-(furan-2-yl)-1,3-thiazol-2-yl]-2-methylbenzimidazole-5-carboxamide with MolForge

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Frequently Asked Questions

What is the IUPAC name of 1-(3-aminopropyl)-N-(5-cyclopenta-1,4-dien-1-yl-1,3,4-thiadiazol-2-yl)-2-methylbenzimidazole-5-carboxamide;1-(3-aminopropyl)-2-ethyl-N-[3-(furan-2-yl)-1,2,4-thiadiazol-5-yl]benzimidazole-5-carboxamide;1-(3-aminopropyl)-2-ethyl-N-[5-(furan-3-yl)-1,3,4-thiadiazol-2-yl]benzimidazole-5-carboxamide;1-(3-aminopropyl)-N-[6-(furan-2-yl)pyridazin-3-yl]benzimidazole-5-carboxamide;1-(3-aminopropyl)-N-[6-(furan-2-yl)pyridazin-3-yl]-2-methylbenzimidazole-5-carboxamide;1-(3-aminopropyl)-N-[3-(furan-2-yl)-1,2,4-thiadiazol-5-yl]-2-methylbenzimidazole-5-carboxamide;1-(3-aminopropyl)-N-[5-(furan-2-yl)-1,3,4-thiadiazol-2-yl]-2-methylbenzimidazole-5-carboxamide;1-(3-aminopropyl)-N-[4-(furan-2-yl)-1,3-thiazol-2-yl]-2-methylbenzimidazole-5-carboxamide?
The IUPAC name of 1-(3-aminopropyl)-N-(5-cyclopenta-1,4-dien-1-yl-1,3,4-thiadiazol-2-yl)-2-methylbenzimidazole-5-carboxamide;1-(3-aminopropyl)-2-ethyl-N-[3-(furan-2-yl)-1,2,4-thiadiazol-5-yl]benzimidazole-5-carboxamide;1-(3-aminopropyl)-2-ethyl-N-[5-(furan-3-yl)-1,3,4-thiadiazol-2-yl]benzimidazole-5-carboxamide;1-(3-aminopropyl)-N-[6-(furan-2-yl)pyridazin-3-yl]benzimidazole-5-carboxamide;1-(3-aminopropyl)-N-[6-(furan-2-yl)pyridazin-3-yl]-2-methylbenzimidazole-5-carboxamide;1-(3-aminopropyl)-N-[3-(furan-2-yl)-1,2,4-thiadiazol-5-yl]-2-methylbenzimidazole-5-carboxamide;1-(3-aminopropyl)-N-[5-(furan-2-yl)-1,3,4-thiadiazol-2-yl]-2-methylbenzimidazole-5-carboxamide;1-(3-aminopropyl)-N-[4-(furan-2-yl)-1,3-thiazol-2-yl]-2-methylbenzimidazole-5-carboxamide (CID 159170515) is 1-(3-aminopropyl)-N-(5-cyclopenta-1,4-dien-1-yl-1,3,4-thiadiazol-2-yl)-2-methylbenzimidazole-5-carboxamide;1-(3-aminopropyl)-2-ethyl-N-[3-(furan-2-yl)-1,2,4-thiadiazol-5-yl]benzimidazole-5-carboxamide;1-(3-aminopropyl)-2-ethyl-N-[5-(furan-3-yl)-1,3,4-thiadiazol-2-yl]benzimidazole-5-carboxamide;1-(3-aminopropyl)-N-[6-(furan-2-yl)pyridazin-3-yl]benzimidazole-5-carboxamide;1-(3-aminopropyl)-N-[6-(furan-2-yl)pyridazin-3-yl]-2-methylbenzimidazole-5-carboxamide;1-(3-aminopropyl)-N-[3-(furan-2-yl)-1,2,4-thiadiazol-5-yl]-2-methylbenzimidazole-5-carboxamide;1-(3-aminopropyl)-N-[5-(furan-2-yl)-1,3,4-thiadiazol-2-yl]-2-methylbenzimidazole-5-carboxamide;1-(3-aminopropyl)-N-[4-(furan-2-yl)-1,3-thiazol-2-yl]-2-methylbenzimidazole-5-carboxamide.
What is the SMILES notation for 1-(3-aminopropyl)-N-(5-cyclopenta-1,4-dien-1-yl-1,3,4-thiadiazol-2-yl)-2-methylbenzimidazole-5-carboxamide;1-(3-aminopropyl)-2-ethyl-N-[3-(furan-2-yl)-1,2,4-thiadiazol-5-yl]benzimidazole-5-carboxamide;1-(3-aminopropyl)-2-ethyl-N-[5-(furan-3-yl)-1,3,4-thiadiazol-2-yl]benzimidazole-5-carboxamide;1-(3-aminopropyl)-N-[6-(furan-2-yl)pyridazin-3-yl]benzimidazole-5-carboxamide;1-(3-aminopropyl)-N-[6-(furan-2-yl)pyridazin-3-yl]-2-methylbenzimidazole-5-carboxamide;1-(3-aminopropyl)-N-[3-(furan-2-yl)-1,2,4-thiadiazol-5-yl]-2-methylbenzimidazole-5-carboxamide;1-(3-aminopropyl)-N-[5-(furan-2-yl)-1,3,4-thiadiazol-2-yl]-2-methylbenzimidazole-5-carboxamide;1-(3-aminopropyl)-N-[4-(furan-2-yl)-1,3-thiazol-2-yl]-2-methylbenzimidazole-5-carboxamide?
The canonical SMILES for 1-(3-aminopropyl)-N-(5-cyclopenta-1,4-dien-1-yl-1,3,4-thiadiazol-2-yl)-2-methylbenzimidazole-5-carboxamide;1-(3-aminopropyl)-2-ethyl-N-[3-(furan-2-yl)-1,2,4-thiadiazol-5-yl]benzimidazole-5-carboxamide;1-(3-aminopropyl)-2-ethyl-N-[5-(furan-3-yl)-1,3,4-thiadiazol-2-yl]benzimidazole-5-carboxamide;1-(3-aminopropyl)-N-[6-(furan-2-yl)pyridazin-3-yl]benzimidazole-5-carboxamide;1-(3-aminopropyl)-N-[6-(furan-2-yl)pyridazin-3-yl]-2-methylbenzimidazole-5-carboxamide;1-(3-aminopropyl)-N-[3-(furan-2-yl)-1,2,4-thiadiazol-5-yl]-2-methylbenzimidazole-5-carboxamide;1-(3-aminopropyl)-N-[5-(furan-2-yl)-1,3,4-thiadiazol-2-yl]-2-methylbenzimidazole-5-carboxamide;1-(3-aminopropyl)-N-[4-(furan-2-yl)-1,3-thiazol-2-yl]-2-methylbenzimidazole-5-carboxamide is CCc1nc2cc(C(=O)Nc3nc(-c4ccco4)ns3)ccc2n1CCCN.CCc1nc2cc(C(=O)Nc3nnc(-c4ccoc4)s3)ccc2n1CCCN.Cc1nc2cc(C(=O)Nc3ccc(-c4ccco4)nn3)ccc2n1CCCN.Cc1nc2cc(C(=O)Nc3nc(-c4ccco4)cs3)ccc2n1CCCN.Cc1nc2cc(C(=O)Nc3nc(-c4ccco4)ns3)ccc2n1CCCN.Cc1nc2cc(C(=O)Nc3nnc(-c4ccco4)s3)ccc2n1CCCN.Cc1nc2cc(C(=O)Nc3nnc(C4=CCC=C4)s3)ccc2n1CCCN.NCCCn1cnc2cc(C(=O)Nc3ccc(-c4ccco4)nn3)ccc21.
What is the InChIKey of 1-(3-aminopropyl)-N-(5-cyclopenta-1,4-dien-1-yl-1,3,4-thiadiazol-2-yl)-2-methylbenzimidazole-5-carboxamide;1-(3-aminopropyl)-2-ethyl-N-[3-(furan-2-yl)-1,2,4-thiadiazol-5-yl]benzimidazole-5-carboxamide;1-(3-aminopropyl)-2-ethyl-N-[5-(furan-3-yl)-1,3,4-thiadiazol-2-yl]benzimidazole-5-carboxamide;1-(3-aminopropyl)-N-[6-(furan-2-yl)pyridazin-3-yl]benzimidazole-5-carboxamide;1-(3-aminopropyl)-N-[6-(furan-2-yl)pyridazin-3-yl]-2-methylbenzimidazole-5-carboxamide;1-(3-aminopropyl)-N-[3-(furan-2-yl)-1,2,4-thiadiazol-5-yl]-2-methylbenzimidazole-5-carboxamide;1-(3-aminopropyl)-N-[5-(furan-2-yl)-1,3,4-thiadiazol-2-yl]-2-methylbenzimidazole-5-carboxamide;1-(3-aminopropyl)-N-[4-(furan-2-yl)-1,3-thiazol-2-yl]-2-methylbenzimidazole-5-carboxamide?
The InChIKey is KLPZFAAMMTUZIU-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H20N6O2.2C19H20N6O2S.C19H18N6O2.C19H20N6OS.C19H19N5O2S.2C18H18N6O2S/c1-13-22-16-12-14(5-7-17(16)26(13)10-3-9-21)20(27)23-19-8-6-15(24-25-19)18-4-2-11-28-18;1-2-16-21-14-10-12(4-5-15(14)25(16)8-3-7-20)17(26)22-19-24-23-18(28-19)13-6-9-27-11-13;1-2-16-21-13-11-12(6-7-14(13)25(16)9-4-8-20)18(26)23-19-22-17(24-28-19)15-5-3-10-27-15;20-8-2-9-25-12-21-15-11-13(4-6-16(15)25)19(26)22-18-7-5-14(23-24-18)17-3-1-10-27-17;1-12-21-15-11-14(7-8-16(15)25(12)10-4-9-20)17(26)22-19-24-23-18(27-19)13-5-2-3-6-13;1-12-21-14-10-13(5-6-16(14)24(12)8-3-7-20)18(25)23-19-22-15(11-27-19)17-4-2-9-26-17;1-11-20-13-10-12(5-6-14(13)24(11)8-3-7-19)17(25)22-18-21-16(23-27-18)15-4-2-9-26-15;1-11-20-13-10-12(5-6-14(13)24(11)8-3-7-19)16(25)21-18-23-22-17(27-18)15-4-2-9-26-15/h2,4-8,11-12H,3,9-10,21H2,1H3,(H,23,25,27);4-6,9-11H,2-3,7-8,20H2,1H3,(H,22,24,26);3,5-7,10-11H,2,4,8-9,20H2,1H3,(H,22,23,24,26);1,3-7,10-12H,2,8-9,20H2,(H,22,24,26);2,5-8,11H,3-4,9-10,20H2,1H3,(H,22,24,26);2,4-6,9-11H,3,7-8,20H2,1H3,(H,22,23,25);2,4-6,9-10H,3,7-8,19H2,1H3,(H,21,22,23,25);2,4-6,9-10H,3,7-8,19H2,1H3,(H,21,23,25).
What are the key properties of 1-(3-aminopropyl)-N-(5-cyclopenta-1,4-dien-1-yl-1,3,4-thiadiazol-2-yl)-2-methylbenzimidazole-5-carboxamide;1-(3-aminopropyl)-2-ethyl-N-[3-(furan-2-yl)-1,2,4-thiadiazol-5-yl]benzimidazole-5-carboxamide;1-(3-aminopropyl)-2-ethyl-N-[5-(furan-3-yl)-1,3,4-thiadiazol-2-yl]benzimidazole-5-carboxamide;1-(3-aminopropyl)-N-[6-(furan-2-yl)pyridazin-3-yl]benzimidazole-5-carboxamide;1-(3-aminopropyl)-N-[6-(furan-2-yl)pyridazin-3-yl]-2-methylbenzimidazole-5-carboxamide;1-(3-aminopropyl)-N-[3-(furan-2-yl)-1,2,4-thiadiazol-5-yl]-2-methylbenzimidazole-5-carboxamide;1-(3-aminopropyl)-N-[5-(furan-2-yl)-1,3,4-thiadiazol-2-yl]-2-methylbenzimidazole-5-carboxamide;1-(3-aminopropyl)-N-[4-(furan-2-yl)-1,3-thiazol-2-yl]-2-methylbenzimidazole-5-carboxamide?
1-(3-aminopropyl)-N-(5-cyclopenta-1,4-dien-1-yl-1,3,4-thiadiazol-2-yl)-2-methylbenzimidazole-5-carboxamide;1-(3-aminopropyl)-2-ethyl-N-[3-(furan-2-yl)-1,2,4-thiadiazol-5-yl]benzimidazole-5-carboxamide;1-(3-aminopropyl)-2-ethyl-N-[5-(furan-3-yl)-1,3,4-thiadiazol-2-yl]benzimidazole-5-carboxamide;1-(3-aminopropyl)-N-[6-(furan-2-yl)pyridazin-3-yl]benzimidazole-5-carboxamide;1-(3-aminopropyl)-N-[6-(furan-2-yl)pyridazin-3-yl]-2-methylbenzimidazole-5-carboxamide;1-(3-aminopropyl)-N-[3-(furan-2-yl)-1,2,4-thiadiazol-5-yl]-2-methylbenzimidazole-5-carboxamide;1-(3-aminopropyl)-N-[5-(furan-2-yl)-1,3,4-thiadiazol-2-yl]-2-methylbenzimidazole-5-carboxamide;1-(3-aminopropyl)-N-[4-(furan-2-yl)-1,3-thiazol-2-yl]-2-methylbenzimidazole-5-carboxamide has a molecular weight of 3058.60 g/mol, XLogP of 25.22, 50 rotatable bonds, 16 hydrogen bond donors, and 60 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3-aminopropyl)-N-(5-cyclopenta-1,4-dien-1-yl-1,3,4-thiadiazol-2-yl)-2-methylbenzimidazole-5-carboxamide;1-(3-aminopropyl)-2-ethyl-N-[3-(furan-2-yl)-1,2,4-thiadiazol-5-yl]benzimidazole-5-carboxamide;1-(3-aminopropyl)-2-ethyl-N-[5-(furan-3-yl)-1,3,4-thiadiazol-2-yl]benzimidazole-5-carboxamide;1-(3-aminopropyl)-N-[6-(furan-2-yl)pyridazin-3-yl]benzimidazole-5-carboxamide;1-(3-aminopropyl)-N-[6-(furan-2-yl)pyridazin-3-yl]-2-methylbenzimidazole-5-carboxamide;1-(3-aminopropyl)-N-[3-(furan-2-yl)-1,2,4-thiadiazol-5-yl]-2-methylbenzimidazole-5-carboxamide;1-(3-aminopropyl)-N-[5-(furan-2-yl)-1,3,4-thiadiazol-2-yl]-2-methylbenzimidazole-5-carboxamide;1-(3-aminopropyl)-N-[4-(furan-2-yl)-1,3-thiazol-2-yl]-2-methylbenzimidazole-5-carboxamide is sourced from PubChem (CID 159170515), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).