2-[4-[4-[[3-(1H-benzimidazol-2-yl)-4-chlorophenyl]carbamoyl]-3-chlorophenyl]sulfonylpiperazin-1-yl]-N-hydroxypyrimidine-5-carboxamide;N-[3-(1H-benzimidazol-2-yl)-4-chlorophenyl]-2-chloro-4-(5-hydroxy-4-oxopentyl)sulfonylbenzamide;2-chloro-N-[4-chloro-3-[6-(dimethylamino)-1H-benzimidazol-2-yl]phenyl]-4-[(4-hydroxy-3-oxobutyl)sulfonylamino]benzamide;2-chloro-N-[4-chloro-3-[6-(dimethylamino)-1H-benzimidazol-2-yl]phenyl]-4-(5-hydroxy-4-oxopentyl)sulfonylbenzamide;2-chloro-N-(4-chloro-3-pyridin-2-ylphenyl)-4-[(4-hydroxy-3-oxobutyl)sulfonylamino]benzamide;2-chloro-N-(4-chloro-3-pyridin-2-ylphenyl)-4-(5-hydroxy-4-oxopentyl)sulfonylbenzamide

C152H135Cl12N25O30S6 — CID 159899189

IUPAC2-[4-[4-[[3-(1H-benzimidazol-2-yl)-4-chlorophenyl]carbamoyl]-3-chlorophenyl]sulfonylpiperazin-1-yl]-N-hydroxypyrimidine-5-carboxamide;N-[3-(1H-benzimidazol-2-yl)-4-chlorophenyl]-2-chloro-4-(5-hydroxy-4-oxopentyl)sulfonylbenzamide;2-chloro-N-[4-chloro-3-[6-(dimethylamino)-1H-benzimidazol-2-yl]phenyl]-4-[(4-hydroxy-3-oxobutyl)sulfonylamino]benzamide;2-chloro-N-[4-chloro-3-[6-(dimethylamino)-1H-benzimidazol-2-yl]phenyl]-4-(5-hydroxy-4-oxopentyl)sulfonylbenzamide;2-chloro-N-(4-chloro-3-pyridin-2-ylphenyl)-4-[(4-hydroxy-3-oxobutyl)sulfonylamino]benzamide;2-chloro-N-(4-chloro-3-pyridin-2-ylphenyl)-4-(5-hydroxy-4-oxopentyl)sulfonylbenzamide
SMILESCN(C)c1ccc2nc(-c3cc(NC(=O)c4ccc(NS(=O)(=O)CCC(=O)CO)cc4Cl)ccc3Cl)[nH]c2c1.CN(C)c1ccc2nc(-c3cc(NC(=O)c4ccc(S(=O)(=O)CCCC(=O)CO)cc4Cl)ccc3Cl)[nH]c2c1.O=C(CO)CCCS(=O)(=O)c1ccc(C(=O)Nc2ccc(Cl)c(-c3ccccn3)c2)c(Cl)c1.O=C(CO)CCCS(=O)(=O)c1ccc(C(=O)Nc2ccc(Cl)c(-c3nc4ccccc4[nH]3)c2)c(Cl)c1.O=C(CO)CCS(=O)(=O)Nc1ccc(C(=O)Nc2ccc(Cl)c(-c3ccccn3)c2)c(Cl)c1.O=C(NO)c1cnc(N2CCN(S(=O)(=O)c3ccc(C(=O)Nc4ccc(Cl)c(-c5nc6ccccc6[nH]5)c4)c(Cl)c3)CC2)nc1
InChIInChI=1S/C29H24Cl2N8O5S.C27H26Cl2N4O5S.C26H25Cl2N5O5S.C25H21Cl2N3O5S.C23H20Cl2N2O5S.C22H19Cl2N3O5S/c30-22-8-5-18(13-21(22)26-35-24-3-1-2-4-25(24)36-26)34-28(41)20-7-6-19(14-23(20)31)45(43,44)39-11-9-38(10-12-39)29-32-15-17(16-33-29)27(40)37-42;1-33(2)17-6-10-24-25(13-17)32-26(31-24)21-12-16(5-9-22(21)28)30-27(36)20-8-7-19(14-23(20)29)39(37,38)11-3-4-18(35)15-34;1-33(2)17-5-8-23-24(13-17)31-25(30-23)20-11-15(4-7-21(20)27)29-26(36)19-6-3-16(12-22(19)28)32-39(37,38)10-9-18(35)14-34;26-20-10-7-15(12-19(20)24-29-22-5-1-2-6-23(22)30-24)28-25(33)18-9-8-17(13-21(18)27)36(34,35)11-3-4-16(32)14-31;24-20-9-6-15(12-19(20)22-5-1-2-10-26-22)27-23(30)18-8-7-17(13-21(18)25)33(31,32)11-3-4-16(29)14-28;23-19-7-5-14(11-18(19)21-3-1-2-9-25-21)26-22(30)17-6-4-15(12-20(17)24)27-33(31,32)10-8-16(29)13-28/h1-8,13-16,42H,9-12H2,(H,34,41)(H,35,36)(H,37,40);5-10,12-14,34H,3-4,11,15H2,1-2H3,(H,30,36)(H,31,32);3-8,11-13,32,34H,9-10,14H2,1-2H3,(H,29,36)(H,30,31);1-2,5-10,12-13,31H,3-4,11,14H2,(H,28,33)(H,29,30);1-2,5-10,12-13,28H,3-4,11,14H2,(H,27,30);1-7,9,11-12,27-28H,8,10,13H2,(H,26,30)
InChIKeyNVSSWOCSPZEEPI-UHFFFAOYSA-N
MW3409.73 g/mol
LogP27.06
Rot. Bonds54

About 2-[4-[4-[[3-(1H-benzimidazol-2-yl)-4-chlorophenyl]carbamoyl]-3-chlorophenyl]sulfonylpiperazin-1-yl]-N-hydroxypyrimidine-5-carboxamide;N-[3-(1H-benzimidazol-2-yl)-4-chlorophenyl]-2-chloro-4-(5-hydroxy-4-oxopentyl)sulfonylbenzamide;2-chloro-N-[4-chloro-3-[6-(dimethylamino)-1H-benzimidazol-2-yl]phenyl]-4-[(4-hydroxy-3-oxobutyl)sulfonylamino]benzamide;2-chloro-N-[4-chloro-3-[6-(dimethylamino)-1H-benzimidazol-2-yl]phenyl]-4-(5-hydroxy-4-oxopentyl)sulfonylbenzamide;2-chloro-N-(4-chloro-3-pyridin-2-ylphenyl)-4-[(4-hydroxy-3-oxobutyl)sulfonylamino]benzamide;2-chloro-N-(4-chloro-3-pyridin-2-ylphenyl)-4-(5-hydroxy-4-oxopentyl)sulfonylbenzamide

2-[4-[4-[[3-(1H-benzimidazol-2-yl)-4-chlorophenyl]carbamoyl]-3-chlorophenyl]sulfonylpiperazin-1-yl]-N-hydroxypyrimidine-5-carboxamide;N-[3-(1H-benzimidazol-2-yl)-4-chlorophenyl]-2-chloro-4-(5-hydroxy-4-oxopentyl)sulfonylbenzamide;2-chloro-N-[4-chloro-3-[6-(dimethylamino)-1H-benzimidazol-2-yl]phenyl]-4-[(4-hydroxy-3-oxobutyl)sulfonylamino]benzamide;2-chloro-N-[4-chloro-3-[6-(dimethylamino)-1H-benzimidazol-2-yl]phenyl]-4-(5-hydroxy-4-oxopentyl)sulfonylbenzamide;2-chloro-N-(4-chloro-3-pyridin-2-ylphenyl)-4-[(4-hydroxy-3-oxobutyl)sulfonylamino]benzamide;2-chloro-N-(4-chloro-3-pyridin-2-ylphenyl)-4-(5-hydroxy-4-oxopentyl)sulfonylbenzamide (PubChem CID 159899189) has the molecular formula C152H135Cl12N25O30S6 and a molecular weight of 3409.73 g/mol. Its IUPAC name is 2-[4-[4-[[3-(1H-benzimidazol-2-yl)-4-chlorophenyl]carbamoyl]-3-chlorophenyl]sulfonylpiperazin-1-yl]-N-hydroxypyrimidine-5-carboxamide;N-[3-(1H-benzimidazol-2-yl)-4-chlorophenyl]-2-chloro-4-(5-hydroxy-4-oxopentyl)sulfonylbenzamide;2-chloro-N-[4-chloro-3-[6-(dimethylamino)-1H-benzimidazol-2-yl]phenyl]-4-[(4-hydroxy-3-oxobutyl)sulfonylamino]benzamide;2-chloro-N-[4-chloro-3-[6-(dimethylamino)-1H-benzimidazol-2-yl]phenyl]-4-(5-hydroxy-4-oxopentyl)sulfonylbenzamide;2-chloro-N-(4-chloro-3-pyridin-2-ylphenyl)-4-[(4-hydroxy-3-oxobutyl)sulfonylamino]benzamide;2-chloro-N-(4-chloro-3-pyridin-2-ylphenyl)-4-(5-hydroxy-4-oxopentyl)sulfonylbenzamide.

Molecular Properties

Compound Name2-[4-[4-[[3-(1H-benzimidazol-2-yl)-4-chlorophenyl]carbamoyl]-3-chlorophenyl]sulfonylpiperazin-1-yl]-N-hydroxypyrimidine-5-carboxamide;N-[3-(1H-benzimidazol-2-yl)-4-chlorophenyl]-2-chloro-4-(5-hydroxy-4-oxopentyl)sulfonylbenzamide;2-chloro-N-[4-chloro-3-[6-(dimethylamino)-1H-benzimidazol-2-yl]phenyl]-4-[(4-hydroxy-3-oxobutyl)sulfonylamino]benzamide;2-chloro-N-[4-chloro-3-[6-(dimethylamino)-1H-benzimidazol-2-yl]phenyl]-4-(5-hydroxy-4-oxopentyl)sulfonylbenzamide;2-chloro-N-(4-chloro-3-pyridin-2-ylphenyl)-4-[(4-hydroxy-3-oxobutyl)sulfonylamino]benzamide;2-chloro-N-(4-chloro-3-pyridin-2-ylphenyl)-4-(5-hydroxy-4-oxopentyl)sulfonylbenzamide
PubChem CID159899189
Molecular FormulaC152H135Cl12N25O30S6
Molecular Weight3409.73 g/mol
Exact Mass3401.44
IUPAC Name2-[4-[4-[[3-(1H-benzimidazol-2-yl)-4-chlorophenyl]carbamoyl]-3-chlorophenyl]sulfonylpiperazin-1-yl]-N-hydroxypyrimidine-5-carboxamide;N-[3-(1H-benzimidazol-2-yl)-4-chlorophenyl]-2-chloro-4-(5-hydroxy-4-oxopentyl)sulfonylbenzamide;2-chloro-N-[4-chloro-3-[6-(dimethylamino)-1H-benzimidazol-2-yl]phenyl]-4-[(4-hydroxy-3-oxobutyl)sulfonylamino]benzamide;2-chloro-N-[4-chloro-3-[6-(dimethylamino)-1H-benzimidazol-2-yl]phenyl]-4-(5-hydroxy-4-oxopentyl)sulfonylbenzamide;2-chloro-N-(4-chloro-3-pyridin-2-ylphenyl)-4-[(4-hydroxy-3-oxobutyl)sulfonylamino]benzamide;2-chloro-N-(4-chloro-3-pyridin-2-ylphenyl)-4-(5-hydroxy-4-oxopentyl)sulfonylbenzamide
SMILESCN(C)c1ccc2nc(-c3cc(NC(=O)c4ccc(NS(=O)(=O)CCC(=O)CO)cc4Cl)ccc3Cl)[nH]c2c1.CN(C)c1ccc2nc(-c3cc(NC(=O)c4ccc(S(=O)(=O)CCCC(=O)CO)cc4Cl)ccc3Cl)[nH]c2c1.O=C(CO)CCCS(=O)(=O)c1ccc(C(=O)Nc2ccc(Cl)c(-c3ccccn3)c2)c(Cl)c1.O=C(CO)CCCS(=O)(=O)c1ccc(C(=O)Nc2ccc(Cl)c(-c3nc4ccccc4[nH]3)c2)c(Cl)c1.O=C(CO)CCS(=O)(=O)Nc1ccc(C(=O)Nc2ccc(Cl)c(-c3ccccn3)c2)c(Cl)c1.O=C(NO)c1cnc(N2CCN(S(=O)(=O)c3ccc(C(=O)Nc4ccc(Cl)c(-c5nc6ccccc6[nH]5)c4)c(Cl)c3)CC2)nc1
InChIInChI=1S/C29H24Cl2N8O5S.C27H26Cl2N4O5S.C26H25Cl2N5O5S.C25H21Cl2N3O5S.C23H20Cl2N2O5S.C22H19Cl2N3O5S/c30-22-8-5-18(13-21(22)26-35-24-3-1-2-4-25(24)36-26)34-28(41)20-7-6-19(14-23(20)31)45(43,44)39-11-9-38(10-12-39)29-32-15-17(16-33-29)27(40)37-42;1-33(2)17-6-10-24-25(13-17)32-26(31-24)21-12-16(5-9-22(21)28)30-27(36)20-8-7-19(14-23(20)29)39(37,38)11-3-4-18(35)15-34;1-33(2)17-5-8-23-24(13-17)31-25(30-23)20-11-15(4-7-21(20)27)29-26(36)19-6-3-16(12-22(19)28)32-39(37,38)10-9-18(35)14-34;26-20-10-7-15(12-19(20)24-29-22-5-1-2-6-23(22)30-24)28-25(33)18-9-8-17(13-21(18)27)36(34,35)11-3-4-16(32)14-31;24-20-9-6-15(12-19(20)22-5-1-2-10-26-22)27-23(30)18-8-7-17(13-21(18)25)33(31,32)11-3-4-16(29)14-28;23-19-7-5-14(11-18(19)21-3-1-2-9-25-21)26-22(30)17-6-4-15(12-20(17)24)27-33(31,32)10-8-16(29)13-28/h1-8,13-16,42H,9-12H2,(H,34,41)(H,35,36)(H,37,40);5-10,12-14,34H,3-4,11,15H2,1-2H3,(H,30,36)(H,31,32);3-8,11-13,32,34H,9-10,14H2,1-2H3,(H,29,36)(H,30,31);1-2,5-10,12-13,31H,3-4,11,14H2,(H,28,33)(H,29,30);1-2,5-10,12-13,28H,3-4,11,14H2,(H,27,30);1-7,9,11-12,27-28H,8,10,13H2,(H,26,30)
InChIKeyNVSSWOCSPZEEPI-UHFFFAOYSA-N
XLogP27.06
TPSA818.57 Ų
H-Bond Donors19
H-Bond Acceptors41
Rotatable Bonds54
Heavy Atoms225
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5003409.73
LogP ≤ 527.06
H-Bond Donors ≤ 519
H-Bond Acceptors ≤ 1041

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydroxamic_acid', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

Analyze 2-[4-[4-[[3-(1H-benzimidazol-2-yl)-4-chlorophenyl]carbamoyl]-3-chlorophenyl]sulfonylpiperazin-1-yl]-N-hydroxypyrimidine-5-carboxamide;N-[3-(1H-benzimidazol-2-yl)-4-chlorophenyl]-2-chloro-4-(5-hydroxy-4-oxopentyl)sulfonylbenzamide;2-chloro-N-[4-chloro-3-[6-(dimethylamino)-1H-benzimidazol-2-yl]phenyl]-4-[(4-hydroxy-3-oxobutyl)sulfonylamino]benzamide;2-chloro-N-[4-chloro-3-[6-(dimethylamino)-1H-benzimidazol-2-yl]phenyl]-4-(5-hydroxy-4-oxopentyl)sulfonylbenzamide;2-chloro-N-(4-chloro-3-pyridin-2-ylphenyl)-4-[(4-hydroxy-3-oxobutyl)sulfonylamino]benzamide;2-chloro-N-(4-chloro-3-pyridin-2-ylphenyl)-4-(5-hydroxy-4-oxopentyl)sulfonylbenzamide with MolForge

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Frequently Asked Questions

What is the IUPAC name of 2-[4-[4-[[3-(1H-benzimidazol-2-yl)-4-chlorophenyl]carbamoyl]-3-chlorophenyl]sulfonylpiperazin-1-yl]-N-hydroxypyrimidine-5-carboxamide;N-[3-(1H-benzimidazol-2-yl)-4-chlorophenyl]-2-chloro-4-(5-hydroxy-4-oxopentyl)sulfonylbenzamide;2-chloro-N-[4-chloro-3-[6-(dimethylamino)-1H-benzimidazol-2-yl]phenyl]-4-[(4-hydroxy-3-oxobutyl)sulfonylamino]benzamide;2-chloro-N-[4-chloro-3-[6-(dimethylamino)-1H-benzimidazol-2-yl]phenyl]-4-(5-hydroxy-4-oxopentyl)sulfonylbenzamide;2-chloro-N-(4-chloro-3-pyridin-2-ylphenyl)-4-[(4-hydroxy-3-oxobutyl)sulfonylamino]benzamide;2-chloro-N-(4-chloro-3-pyridin-2-ylphenyl)-4-(5-hydroxy-4-oxopentyl)sulfonylbenzamide?
The IUPAC name of 2-[4-[4-[[3-(1H-benzimidazol-2-yl)-4-chlorophenyl]carbamoyl]-3-chlorophenyl]sulfonylpiperazin-1-yl]-N-hydroxypyrimidine-5-carboxamide;N-[3-(1H-benzimidazol-2-yl)-4-chlorophenyl]-2-chloro-4-(5-hydroxy-4-oxopentyl)sulfonylbenzamide;2-chloro-N-[4-chloro-3-[6-(dimethylamino)-1H-benzimidazol-2-yl]phenyl]-4-[(4-hydroxy-3-oxobutyl)sulfonylamino]benzamide;2-chloro-N-[4-chloro-3-[6-(dimethylamino)-1H-benzimidazol-2-yl]phenyl]-4-(5-hydroxy-4-oxopentyl)sulfonylbenzamide;2-chloro-N-(4-chloro-3-pyridin-2-ylphenyl)-4-[(4-hydroxy-3-oxobutyl)sulfonylamino]benzamide;2-chloro-N-(4-chloro-3-pyridin-2-ylphenyl)-4-(5-hydroxy-4-oxopentyl)sulfonylbenzamide (CID 159899189) is 2-[4-[4-[[3-(1H-benzimidazol-2-yl)-4-chlorophenyl]carbamoyl]-3-chlorophenyl]sulfonylpiperazin-1-yl]-N-hydroxypyrimidine-5-carboxamide;N-[3-(1H-benzimidazol-2-yl)-4-chlorophenyl]-2-chloro-4-(5-hydroxy-4-oxopentyl)sulfonylbenzamide;2-chloro-N-[4-chloro-3-[6-(dimethylamino)-1H-benzimidazol-2-yl]phenyl]-4-[(4-hydroxy-3-oxobutyl)sulfonylamino]benzamide;2-chloro-N-[4-chloro-3-[6-(dimethylamino)-1H-benzimidazol-2-yl]phenyl]-4-(5-hydroxy-4-oxopentyl)sulfonylbenzamide;2-chloro-N-(4-chloro-3-pyridin-2-ylphenyl)-4-[(4-hydroxy-3-oxobutyl)sulfonylamino]benzamide;2-chloro-N-(4-chloro-3-pyridin-2-ylphenyl)-4-(5-hydroxy-4-oxopentyl)sulfonylbenzamide.
What is the SMILES notation for 2-[4-[4-[[3-(1H-benzimidazol-2-yl)-4-chlorophenyl]carbamoyl]-3-chlorophenyl]sulfonylpiperazin-1-yl]-N-hydroxypyrimidine-5-carboxamide;N-[3-(1H-benzimidazol-2-yl)-4-chlorophenyl]-2-chloro-4-(5-hydroxy-4-oxopentyl)sulfonylbenzamide;2-chloro-N-[4-chloro-3-[6-(dimethylamino)-1H-benzimidazol-2-yl]phenyl]-4-[(4-hydroxy-3-oxobutyl)sulfonylamino]benzamide;2-chloro-N-[4-chloro-3-[6-(dimethylamino)-1H-benzimidazol-2-yl]phenyl]-4-(5-hydroxy-4-oxopentyl)sulfonylbenzamide;2-chloro-N-(4-chloro-3-pyridin-2-ylphenyl)-4-[(4-hydroxy-3-oxobutyl)sulfonylamino]benzamide;2-chloro-N-(4-chloro-3-pyridin-2-ylphenyl)-4-(5-hydroxy-4-oxopentyl)sulfonylbenzamide?
The canonical SMILES for 2-[4-[4-[[3-(1H-benzimidazol-2-yl)-4-chlorophenyl]carbamoyl]-3-chlorophenyl]sulfonylpiperazin-1-yl]-N-hydroxypyrimidine-5-carboxamide;N-[3-(1H-benzimidazol-2-yl)-4-chlorophenyl]-2-chloro-4-(5-hydroxy-4-oxopentyl)sulfonylbenzamide;2-chloro-N-[4-chloro-3-[6-(dimethylamino)-1H-benzimidazol-2-yl]phenyl]-4-[(4-hydroxy-3-oxobutyl)sulfonylamino]benzamide;2-chloro-N-[4-chloro-3-[6-(dimethylamino)-1H-benzimidazol-2-yl]phenyl]-4-(5-hydroxy-4-oxopentyl)sulfonylbenzamide;2-chloro-N-(4-chloro-3-pyridin-2-ylphenyl)-4-[(4-hydroxy-3-oxobutyl)sulfonylamino]benzamide;2-chloro-N-(4-chloro-3-pyridin-2-ylphenyl)-4-(5-hydroxy-4-oxopentyl)sulfonylbenzamide is CN(C)c1ccc2nc(-c3cc(NC(=O)c4ccc(NS(=O)(=O)CCC(=O)CO)cc4Cl)ccc3Cl)[nH]c2c1.CN(C)c1ccc2nc(-c3cc(NC(=O)c4ccc(S(=O)(=O)CCCC(=O)CO)cc4Cl)ccc3Cl)[nH]c2c1.O=C(CO)CCCS(=O)(=O)c1ccc(C(=O)Nc2ccc(Cl)c(-c3ccccn3)c2)c(Cl)c1.O=C(CO)CCCS(=O)(=O)c1ccc(C(=O)Nc2ccc(Cl)c(-c3nc4ccccc4[nH]3)c2)c(Cl)c1.O=C(CO)CCS(=O)(=O)Nc1ccc(C(=O)Nc2ccc(Cl)c(-c3ccccn3)c2)c(Cl)c1.O=C(NO)c1cnc(N2CCN(S(=O)(=O)c3ccc(C(=O)Nc4ccc(Cl)c(-c5nc6ccccc6[nH]5)c4)c(Cl)c3)CC2)nc1.
What is the InChIKey of 2-[4-[4-[[3-(1H-benzimidazol-2-yl)-4-chlorophenyl]carbamoyl]-3-chlorophenyl]sulfonylpiperazin-1-yl]-N-hydroxypyrimidine-5-carboxamide;N-[3-(1H-benzimidazol-2-yl)-4-chlorophenyl]-2-chloro-4-(5-hydroxy-4-oxopentyl)sulfonylbenzamide;2-chloro-N-[4-chloro-3-[6-(dimethylamino)-1H-benzimidazol-2-yl]phenyl]-4-[(4-hydroxy-3-oxobutyl)sulfonylamino]benzamide;2-chloro-N-[4-chloro-3-[6-(dimethylamino)-1H-benzimidazol-2-yl]phenyl]-4-(5-hydroxy-4-oxopentyl)sulfonylbenzamide;2-chloro-N-(4-chloro-3-pyridin-2-ylphenyl)-4-[(4-hydroxy-3-oxobutyl)sulfonylamino]benzamide;2-chloro-N-(4-chloro-3-pyridin-2-ylphenyl)-4-(5-hydroxy-4-oxopentyl)sulfonylbenzamide?
The InChIKey is NVSSWOCSPZEEPI-UHFFFAOYSA-N. The full InChI is InChI=1S/C29H24Cl2N8O5S.C27H26Cl2N4O5S.C26H25Cl2N5O5S.C25H21Cl2N3O5S.C23H20Cl2N2O5S.C22H19Cl2N3O5S/c30-22-8-5-18(13-21(22)26-35-24-3-1-2-4-25(24)36-26)34-28(41)20-7-6-19(14-23(20)31)45(43,44)39-11-9-38(10-12-39)29-32-15-17(16-33-29)27(40)37-42;1-33(2)17-6-10-24-25(13-17)32-26(31-24)21-12-16(5-9-22(21)28)30-27(36)20-8-7-19(14-23(20)29)39(37,38)11-3-4-18(35)15-34;1-33(2)17-5-8-23-24(13-17)31-25(30-23)20-11-15(4-7-21(20)27)29-26(36)19-6-3-16(12-22(19)28)32-39(37,38)10-9-18(35)14-34;26-20-10-7-15(12-19(20)24-29-22-5-1-2-6-23(22)30-24)28-25(33)18-9-8-17(13-21(18)27)36(34,35)11-3-4-16(32)14-31;24-20-9-6-15(12-19(20)22-5-1-2-10-26-22)27-23(30)18-8-7-17(13-21(18)25)33(31,32)11-3-4-16(29)14-28;23-19-7-5-14(11-18(19)21-3-1-2-9-25-21)26-22(30)17-6-4-15(12-20(17)24)27-33(31,32)10-8-16(29)13-28/h1-8,13-16,42H,9-12H2,(H,34,41)(H,35,36)(H,37,40);5-10,12-14,34H,3-4,11,15H2,1-2H3,(H,30,36)(H,31,32);3-8,11-13,32,34H,9-10,14H2,1-2H3,(H,29,36)(H,30,31);1-2,5-10,12-13,31H,3-4,11,14H2,(H,28,33)(H,29,30);1-2,5-10,12-13,28H,3-4,11,14H2,(H,27,30);1-7,9,11-12,27-28H,8,10,13H2,(H,26,30).
What are the key properties of 2-[4-[4-[[3-(1H-benzimidazol-2-yl)-4-chlorophenyl]carbamoyl]-3-chlorophenyl]sulfonylpiperazin-1-yl]-N-hydroxypyrimidine-5-carboxamide;N-[3-(1H-benzimidazol-2-yl)-4-chlorophenyl]-2-chloro-4-(5-hydroxy-4-oxopentyl)sulfonylbenzamide;2-chloro-N-[4-chloro-3-[6-(dimethylamino)-1H-benzimidazol-2-yl]phenyl]-4-[(4-hydroxy-3-oxobutyl)sulfonylamino]benzamide;2-chloro-N-[4-chloro-3-[6-(dimethylamino)-1H-benzimidazol-2-yl]phenyl]-4-(5-hydroxy-4-oxopentyl)sulfonylbenzamide;2-chloro-N-(4-chloro-3-pyridin-2-ylphenyl)-4-[(4-hydroxy-3-oxobutyl)sulfonylamino]benzamide;2-chloro-N-(4-chloro-3-pyridin-2-ylphenyl)-4-(5-hydroxy-4-oxopentyl)sulfonylbenzamide?
2-[4-[4-[[3-(1H-benzimidazol-2-yl)-4-chlorophenyl]carbamoyl]-3-chlorophenyl]sulfonylpiperazin-1-yl]-N-hydroxypyrimidine-5-carboxamide;N-[3-(1H-benzimidazol-2-yl)-4-chlorophenyl]-2-chloro-4-(5-hydroxy-4-oxopentyl)sulfonylbenzamide;2-chloro-N-[4-chloro-3-[6-(dimethylamino)-1H-benzimidazol-2-yl]phenyl]-4-[(4-hydroxy-3-oxobutyl)sulfonylamino]benzamide;2-chloro-N-[4-chloro-3-[6-(dimethylamino)-1H-benzimidazol-2-yl]phenyl]-4-(5-hydroxy-4-oxopentyl)sulfonylbenzamide;2-chloro-N-(4-chloro-3-pyridin-2-ylphenyl)-4-[(4-hydroxy-3-oxobutyl)sulfonylamino]benzamide;2-chloro-N-(4-chloro-3-pyridin-2-ylphenyl)-4-(5-hydroxy-4-oxopentyl)sulfonylbenzamide has a molecular weight of 3409.73 g/mol, XLogP of 27.06, 54 rotatable bonds, 19 hydrogen bond donors, and 41 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-[4-[[3-(1H-benzimidazol-2-yl)-4-chlorophenyl]carbamoyl]-3-chlorophenyl]sulfonylpiperazin-1-yl]-N-hydroxypyrimidine-5-carboxamide;N-[3-(1H-benzimidazol-2-yl)-4-chlorophenyl]-2-chloro-4-(5-hydroxy-4-oxopentyl)sulfonylbenzamide;2-chloro-N-[4-chloro-3-[6-(dimethylamino)-1H-benzimidazol-2-yl]phenyl]-4-[(4-hydroxy-3-oxobutyl)sulfonylamino]benzamide;2-chloro-N-[4-chloro-3-[6-(dimethylamino)-1H-benzimidazol-2-yl]phenyl]-4-(5-hydroxy-4-oxopentyl)sulfonylbenzamide;2-chloro-N-(4-chloro-3-pyridin-2-ylphenyl)-4-[(4-hydroxy-3-oxobutyl)sulfonylamino]benzamide;2-chloro-N-(4-chloro-3-pyridin-2-ylphenyl)-4-(5-hydroxy-4-oxopentyl)sulfonylbenzamide is sourced from PubChem (CID 159899189), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).