N-benzyl-4-[[4-[benzyl(methyl)sulfamoyl]phenyl]methyl]piperazine-1-carboxamide;N-benzyl-N-(cyclopropylmethyl)-4-(piperazin-1-ylmethyl)benzenesulfonamide;N-benzyl-N-(cyclopropylmethyl)-4-[(5,6,7,8-tetrahydroquinolin-8-ylamino)methyl]benzenesulfonamide;N-benzyl-4-[(1H-imidazol-2-ylmethylamino)methyl]-N-methylbenzenesulfonamide;N-benzyl-N-methyl-4-[(pyridin-2-ylmethylamino)methyl]benzenesulfonamide;4-[[4-[benzyl(methyl)sulfamoyl]phenyl]methyl]-N-(1H-imidazol-2-ylmethyl)piperazine-1-carboxamide;N-[[3-[2-(diethylamino)ethoxy]phenyl]methyl]-4-[(3-morpholin-4-ylpropylamino)methyl]benzenesulfonamide;N-[4-[2-(diethylamino)ethoxy]phenyl]-4-(piperazin-1-ylmethyl)benzenesulfonamide

C190H243N31O21S8 — CID 159399547

IUPACN-benzyl-4-[[4-[benzyl(methyl)sulfamoyl]phenyl]methyl]piperazine-1-carboxamide;N-benzyl-N-(cyclopropylmethyl)-4-(piperazin-1-ylmethyl)benzenesulfonamide;N-benzyl-N-(cyclopropylmethyl)-4-[(5,6,7,8-tetrahydroquinolin-8-ylamino)methyl]benzenesulfonamide;N-benzyl-4-[(1H-imidazol-2-ylmethylamino)methyl]-N-methylbenzenesulfonamide;N-benzyl-N-methyl-4-[(pyridin-2-ylmethylamino)methyl]benzenesulfonamide;4-[[4-[benzyl(methyl)sulfamoyl]phenyl]methyl]-N-(1H-imidazol-2-ylmethyl)piperazine-1-carboxamide;N-[[3-[2-(diethylamino)ethoxy]phenyl]methyl]-4-[(3-morpholin-4-ylpropylamino)methyl]benzenesulfonamide;N-[4-[2-(diethylamino)ethoxy]phenyl]-4-(piperazin-1-ylmethyl)benzenesulfonamide
SMILESCCN(CC)CCOc1ccc(NS(=O)(=O)c2ccc(CN3CCNCC3)cc2)cc1.CCN(CC)CCOc1cccc(CNS(=O)(=O)c2ccc(CNCCCN3CCOCC3)cc2)c1.CN(Cc1ccccc1)S(=O)(=O)c1ccc(CN2CCN(C(=O)NCc3ccccc3)CC2)cc1.CN(Cc1ccccc1)S(=O)(=O)c1ccc(CN2CCN(C(=O)NCc3ncc[nH]3)CC2)cc1.CN(Cc1ccccc1)S(=O)(=O)c1ccc(CNCc2ccccn2)cc1.CN(Cc1ccccc1)S(=O)(=O)c1ccc(CNCc2ncc[nH]2)cc1.O=S(=O)(c1ccc(CN2CCNCC2)cc1)N(Cc1ccccc1)CC1CC1.O=S(=O)(c1ccc(CNC2CCCc3cccnc32)cc1)N(Cc1ccccc1)CC1CC1
InChIInChI=1S/C27H42N4O4S.C27H32N4O3S.C27H31N3O2S.C24H30N6O3S.C23H34N4O3S.C22H29N3O2S.C21H23N3O2S.C19H22N4O2S/c1-3-30(4-2)17-20-35-26-8-5-7-25(21-26)23-29-36(32,33)27-11-9-24(10-12-27)22-28-13-6-14-31-15-18-34-19-16-31;1-29(21-24-10-6-3-7-11-24)35(33,34)26-14-12-25(13-15-26)22-30-16-18-31(19-17-30)27(32)28-20-23-8-4-2-5-9-23;31-33(32,30(20-23-11-12-23)19-22-6-2-1-3-7-22)25-15-13-21(14-16-25)18-29-26-10-4-8-24-9-5-17-28-27(24)26;1-28(18-20-5-3-2-4-6-20)34(32,33)22-9-7-21(8-10-22)19-29-13-15-30(16-14-29)24(31)27-17-23-25-11-12-26-23;1-3-26(4-2)17-18-30-22-9-7-21(8-10-22)25-31(28,29)23-11-5-20(6-12-23)19-27-15-13-24-14-16-27;26-28(27,25(18-21-6-7-21)17-19-4-2-1-3-5-19)22-10-8-20(9-11-22)16-24-14-12-23-13-15-24;1-24(17-19-7-3-2-4-8-19)27(25,26)21-12-10-18(11-13-21)15-22-16-20-9-5-6-14-23-20;1-23(15-17-5-3-2-4-6-17)26(24,25)18-9-7-16(8-10-18)13-20-14-19-21-11-12-22-19/h5,7-12,21,28-29H,3-4,6,13-20,22-23H2,1-2H3;2-15H,16-22H2,1H3,(H,28,32);1-3,5-7,9,13-17,23,26,29H,4,8,10-12,18-20H2;2-12H,13-19H2,1H3,(H,25,26)(H,27,31);5-12,24-25H,3-4,13-19H2,1-2H3;1-5,8-11,21,23H,6-7,12-18H2;2-14,22H,15-17H2,1H3;2-12,20H,13-15H2,1H3,(H,21,22)
InChIKeyLNDWMURWMUYZDL-UHFFFAOYSA-N
MW3553.77 g/mol
LogP24.36
Rot. Bonds76

About N-benzyl-4-[[4-[benzyl(methyl)sulfamoyl]phenyl]methyl]piperazine-1-carboxamide;N-benzyl-N-(cyclopropylmethyl)-4-(piperazin-1-ylmethyl)benzenesulfonamide;N-benzyl-N-(cyclopropylmethyl)-4-[(5,6,7,8-tetrahydroquinolin-8-ylamino)methyl]benzenesulfonamide;N-benzyl-4-[(1H-imidazol-2-ylmethylamino)methyl]-N-methylbenzenesulfonamide;N-benzyl-N-methyl-4-[(pyridin-2-ylmethylamino)methyl]benzenesulfonamide;4-[[4-[benzyl(methyl)sulfamoyl]phenyl]methyl]-N-(1H-imidazol-2-ylmethyl)piperazine-1-carboxamide;N-[[3-[2-(diethylamino)ethoxy]phenyl]methyl]-4-[(3-morpholin-4-ylpropylamino)methyl]benzenesulfonamide;N-[4-[2-(diethylamino)ethoxy]phenyl]-4-(piperazin-1-ylmethyl)benzenesulfonamide

N-benzyl-4-[[4-[benzyl(methyl)sulfamoyl]phenyl]methyl]piperazine-1-carboxamide;N-benzyl-N-(cyclopropylmethyl)-4-(piperazin-1-ylmethyl)benzenesulfonamide;N-benzyl-N-(cyclopropylmethyl)-4-[(5,6,7,8-tetrahydroquinolin-8-ylamino)methyl]benzenesulfonamide;N-benzyl-4-[(1H-imidazol-2-ylmethylamino)methyl]-N-methylbenzenesulfonamide;N-benzyl-N-methyl-4-[(pyridin-2-ylmethylamino)methyl]benzenesulfonamide;4-[[4-[benzyl(methyl)sulfamoyl]phenyl]methyl]-N-(1H-imidazol-2-ylmethyl)piperazine-1-carboxamide;N-[[3-[2-(diethylamino)ethoxy]phenyl]methyl]-4-[(3-morpholin-4-ylpropylamino)methyl]benzenesulfonamide;N-[4-[2-(diethylamino)ethoxy]phenyl]-4-(piperazin-1-ylmethyl)benzenesulfonamide (PubChem CID 159399547) has the molecular formula C190H243N31O21S8 and a molecular weight of 3553.77 g/mol. Its IUPAC name is N-benzyl-4-[[4-[benzyl(methyl)sulfamoyl]phenyl]methyl]piperazine-1-carboxamide;N-benzyl-N-(cyclopropylmethyl)-4-(piperazin-1-ylmethyl)benzenesulfonamide;N-benzyl-N-(cyclopropylmethyl)-4-[(5,6,7,8-tetrahydroquinolin-8-ylamino)methyl]benzenesulfonamide;N-benzyl-4-[(1H-imidazol-2-ylmethylamino)methyl]-N-methylbenzenesulfonamide;N-benzyl-N-methyl-4-[(pyridin-2-ylmethylamino)methyl]benzenesulfonamide;4-[[4-[benzyl(methyl)sulfamoyl]phenyl]methyl]-N-(1H-imidazol-2-ylmethyl)piperazine-1-carboxamide;N-[[3-[2-(diethylamino)ethoxy]phenyl]methyl]-4-[(3-morpholin-4-ylpropylamino)methyl]benzenesulfonamide;N-[4-[2-(diethylamino)ethoxy]phenyl]-4-(piperazin-1-ylmethyl)benzenesulfonamide.

Molecular Properties

Compound NameN-benzyl-4-[[4-[benzyl(methyl)sulfamoyl]phenyl]methyl]piperazine-1-carboxamide;N-benzyl-N-(cyclopropylmethyl)-4-(piperazin-1-ylmethyl)benzenesulfonamide;N-benzyl-N-(cyclopropylmethyl)-4-[(5,6,7,8-tetrahydroquinolin-8-ylamino)methyl]benzenesulfonamide;N-benzyl-4-[(1H-imidazol-2-ylmethylamino)methyl]-N-methylbenzenesulfonamide;N-benzyl-N-methyl-4-[(pyridin-2-ylmethylamino)methyl]benzenesulfonamide;4-[[4-[benzyl(methyl)sulfamoyl]phenyl]methyl]-N-(1H-imidazol-2-ylmethyl)piperazine-1-carboxamide;N-[[3-[2-(diethylamino)ethoxy]phenyl]methyl]-4-[(3-morpholin-4-ylpropylamino)methyl]benzenesulfonamide;N-[4-[2-(diethylamino)ethoxy]phenyl]-4-(piperazin-1-ylmethyl)benzenesulfonamide
PubChem CID159399547
Molecular FormulaC190H243N31O21S8
Molecular Weight3553.77 g/mol
Exact Mass3550.67
IUPAC NameN-benzyl-4-[[4-[benzyl(methyl)sulfamoyl]phenyl]methyl]piperazine-1-carboxamide;N-benzyl-N-(cyclopropylmethyl)-4-(piperazin-1-ylmethyl)benzenesulfonamide;N-benzyl-N-(cyclopropylmethyl)-4-[(5,6,7,8-tetrahydroquinolin-8-ylamino)methyl]benzenesulfonamide;N-benzyl-4-[(1H-imidazol-2-ylmethylamino)methyl]-N-methylbenzenesulfonamide;N-benzyl-N-methyl-4-[(pyridin-2-ylmethylamino)methyl]benzenesulfonamide;4-[[4-[benzyl(methyl)sulfamoyl]phenyl]methyl]-N-(1H-imidazol-2-ylmethyl)piperazine-1-carboxamide;N-[[3-[2-(diethylamino)ethoxy]phenyl]methyl]-4-[(3-morpholin-4-ylpropylamino)methyl]benzenesulfonamide;N-[4-[2-(diethylamino)ethoxy]phenyl]-4-(piperazin-1-ylmethyl)benzenesulfonamide
SMILESCCN(CC)CCOc1ccc(NS(=O)(=O)c2ccc(CN3CCNCC3)cc2)cc1.CCN(CC)CCOc1cccc(CNS(=O)(=O)c2ccc(CNCCCN3CCOCC3)cc2)c1.CN(Cc1ccccc1)S(=O)(=O)c1ccc(CN2CCN(C(=O)NCc3ccccc3)CC2)cc1.CN(Cc1ccccc1)S(=O)(=O)c1ccc(CN2CCN(C(=O)NCc3ncc[nH]3)CC2)cc1.CN(Cc1ccccc1)S(=O)(=O)c1ccc(CNCc2ccccn2)cc1.CN(Cc1ccccc1)S(=O)(=O)c1ccc(CNCc2ncc[nH]2)cc1.O=S(=O)(c1ccc(CN2CCNCC2)cc1)N(Cc1ccccc1)CC1CC1.O=S(=O)(c1ccc(CNC2CCCc3cccnc32)cc1)N(Cc1ccccc1)CC1CC1
InChIInChI=1S/C27H42N4O4S.C27H32N4O3S.C27H31N3O2S.C24H30N6O3S.C23H34N4O3S.C22H29N3O2S.C21H23N3O2S.C19H22N4O2S/c1-3-30(4-2)17-20-35-26-8-5-7-25(21-26)23-29-36(32,33)27-11-9-24(10-12-27)22-28-13-6-14-31-15-18-34-19-16-31;1-29(21-24-10-6-3-7-11-24)35(33,34)26-14-12-25(13-15-26)22-30-16-18-31(19-17-30)27(32)28-20-23-8-4-2-5-9-23;31-33(32,30(20-23-11-12-23)19-22-6-2-1-3-7-22)25-15-13-21(14-16-25)18-29-26-10-4-8-24-9-5-17-28-27(24)26;1-28(18-20-5-3-2-4-6-20)34(32,33)22-9-7-21(8-10-22)19-29-13-15-30(16-14-29)24(31)27-17-23-25-11-12-26-23;1-3-26(4-2)17-18-30-22-9-7-21(8-10-22)25-31(28,29)23-11-5-20(6-12-23)19-27-15-13-24-14-16-27;26-28(27,25(18-21-6-7-21)17-19-4-2-1-3-5-19)22-10-8-20(9-11-22)16-24-14-12-23-13-15-24;1-24(17-19-7-3-2-4-8-19)27(25,26)21-12-10-18(11-13-21)15-22-16-20-9-5-6-14-23-20;1-23(15-17-5-3-2-4-6-17)26(24,25)18-9-7-16(8-10-18)13-20-14-19-21-11-12-22-19/h5,7-12,21,28-29H,3-4,6,13-20,22-23H2,1-2H3;2-15H,16-22H2,1H3,(H,28,32);1-3,5-7,9,13-17,23,26,29H,4,8,10-12,18-20H2;2-12H,13-19H2,1H3,(H,25,26)(H,27,31);5-12,24-25H,3-4,13-19H2,1-2H3;1-5,8-11,21,23H,6-7,12-18H2;2-14,22H,15-17H2,1H3;2-12,20H,13-15H2,1H3,(H,21,22)
InChIKeyLNDWMURWMUYZDL-UHFFFAOYSA-N
XLogP24.36
TPSA586.99 Ų
H-Bond Donors12
H-Bond Acceptors38
Rotatable Bonds76
Heavy Atoms250
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5003553.77
LogP ≤ 524.36
H-Bond Donors ≤ 512
H-Bond Acceptors ≤ 1038

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

Analyze N-benzyl-4-[[4-[benzyl(methyl)sulfamoyl]phenyl]methyl]piperazine-1-carboxamide;N-benzyl-N-(cyclopropylmethyl)-4-(piperazin-1-ylmethyl)benzenesulfonamide;N-benzyl-N-(cyclopropylmethyl)-4-[(5,6,7,8-tetrahydroquinolin-8-ylamino)methyl]benzenesulfonamide;N-benzyl-4-[(1H-imidazol-2-ylmethylamino)methyl]-N-methylbenzenesulfonamide;N-benzyl-N-methyl-4-[(pyridin-2-ylmethylamino)methyl]benzenesulfonamide;4-[[4-[benzyl(methyl)sulfamoyl]phenyl]methyl]-N-(1H-imidazol-2-ylmethyl)piperazine-1-carboxamide;N-[[3-[2-(diethylamino)ethoxy]phenyl]methyl]-4-[(3-morpholin-4-ylpropylamino)methyl]benzenesulfonamide;N-[4-[2-(diethylamino)ethoxy]phenyl]-4-(piperazin-1-ylmethyl)benzenesulfonamide with MolForge

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Related Compounds

N-benzyl-4-[[bis(1H-imidazol-2-ylmethyl)amino]methyl]-N-methylbenzenesulfonamide;N-benzyl-N-(cyclopropylmethyl)-4-[(pyridin-2-ylmethylamino)methyl]benzenesulfonamide;N-benzyl-4-[(1H-imidazol-2-ylmethylamino)methyl]-N-methylbenzenesulfonamide;N,N-dibenzyl-4-[(pyridin-3-ylmethylamino)methyl]benzenesulfonamide;N,N-dibenzyl-4-[(pyridin-4-ylmethylamino)methyl]benzenesulfonamide;N-[4-[2-(diethylamino)ethoxy]phenyl]-4-[(pyrimidin-2-ylamino)methyl]benzenesulfonamide;N-[[4-[[4-[2-(diethylamino)ethoxy]phenyl]sulfamoyl]phenyl]methyl]acetamide
CID 158502484

Frequently Asked Questions

What is the IUPAC name of N-benzyl-4-[[4-[benzyl(methyl)sulfamoyl]phenyl]methyl]piperazine-1-carboxamide;N-benzyl-N-(cyclopropylmethyl)-4-(piperazin-1-ylmethyl)benzenesulfonamide;N-benzyl-N-(cyclopropylmethyl)-4-[(5,6,7,8-tetrahydroquinolin-8-ylamino)methyl]benzenesulfonamide;N-benzyl-4-[(1H-imidazol-2-ylmethylamino)methyl]-N-methylbenzenesulfonamide;N-benzyl-N-methyl-4-[(pyridin-2-ylmethylamino)methyl]benzenesulfonamide;4-[[4-[benzyl(methyl)sulfamoyl]phenyl]methyl]-N-(1H-imidazol-2-ylmethyl)piperazine-1-carboxamide;N-[[3-[2-(diethylamino)ethoxy]phenyl]methyl]-4-[(3-morpholin-4-ylpropylamino)methyl]benzenesulfonamide;N-[4-[2-(diethylamino)ethoxy]phenyl]-4-(piperazin-1-ylmethyl)benzenesulfonamide?
The IUPAC name of N-benzyl-4-[[4-[benzyl(methyl)sulfamoyl]phenyl]methyl]piperazine-1-carboxamide;N-benzyl-N-(cyclopropylmethyl)-4-(piperazin-1-ylmethyl)benzenesulfonamide;N-benzyl-N-(cyclopropylmethyl)-4-[(5,6,7,8-tetrahydroquinolin-8-ylamino)methyl]benzenesulfonamide;N-benzyl-4-[(1H-imidazol-2-ylmethylamino)methyl]-N-methylbenzenesulfonamide;N-benzyl-N-methyl-4-[(pyridin-2-ylmethylamino)methyl]benzenesulfonamide;4-[[4-[benzyl(methyl)sulfamoyl]phenyl]methyl]-N-(1H-imidazol-2-ylmethyl)piperazine-1-carboxamide;N-[[3-[2-(diethylamino)ethoxy]phenyl]methyl]-4-[(3-morpholin-4-ylpropylamino)methyl]benzenesulfonamide;N-[4-[2-(diethylamino)ethoxy]phenyl]-4-(piperazin-1-ylmethyl)benzenesulfonamide (CID 159399547) is N-benzyl-4-[[4-[benzyl(methyl)sulfamoyl]phenyl]methyl]piperazine-1-carboxamide;N-benzyl-N-(cyclopropylmethyl)-4-(piperazin-1-ylmethyl)benzenesulfonamide;N-benzyl-N-(cyclopropylmethyl)-4-[(5,6,7,8-tetrahydroquinolin-8-ylamino)methyl]benzenesulfonamide;N-benzyl-4-[(1H-imidazol-2-ylmethylamino)methyl]-N-methylbenzenesulfonamide;N-benzyl-N-methyl-4-[(pyridin-2-ylmethylamino)methyl]benzenesulfonamide;4-[[4-[benzyl(methyl)sulfamoyl]phenyl]methyl]-N-(1H-imidazol-2-ylmethyl)piperazine-1-carboxamide;N-[[3-[2-(diethylamino)ethoxy]phenyl]methyl]-4-[(3-morpholin-4-ylpropylamino)methyl]benzenesulfonamide;N-[4-[2-(diethylamino)ethoxy]phenyl]-4-(piperazin-1-ylmethyl)benzenesulfonamide.
What is the SMILES notation for N-benzyl-4-[[4-[benzyl(methyl)sulfamoyl]phenyl]methyl]piperazine-1-carboxamide;N-benzyl-N-(cyclopropylmethyl)-4-(piperazin-1-ylmethyl)benzenesulfonamide;N-benzyl-N-(cyclopropylmethyl)-4-[(5,6,7,8-tetrahydroquinolin-8-ylamino)methyl]benzenesulfonamide;N-benzyl-4-[(1H-imidazol-2-ylmethylamino)methyl]-N-methylbenzenesulfonamide;N-benzyl-N-methyl-4-[(pyridin-2-ylmethylamino)methyl]benzenesulfonamide;4-[[4-[benzyl(methyl)sulfamoyl]phenyl]methyl]-N-(1H-imidazol-2-ylmethyl)piperazine-1-carboxamide;N-[[3-[2-(diethylamino)ethoxy]phenyl]methyl]-4-[(3-morpholin-4-ylpropylamino)methyl]benzenesulfonamide;N-[4-[2-(diethylamino)ethoxy]phenyl]-4-(piperazin-1-ylmethyl)benzenesulfonamide?
The canonical SMILES for N-benzyl-4-[[4-[benzyl(methyl)sulfamoyl]phenyl]methyl]piperazine-1-carboxamide;N-benzyl-N-(cyclopropylmethyl)-4-(piperazin-1-ylmethyl)benzenesulfonamide;N-benzyl-N-(cyclopropylmethyl)-4-[(5,6,7,8-tetrahydroquinolin-8-ylamino)methyl]benzenesulfonamide;N-benzyl-4-[(1H-imidazol-2-ylmethylamino)methyl]-N-methylbenzenesulfonamide;N-benzyl-N-methyl-4-[(pyridin-2-ylmethylamino)methyl]benzenesulfonamide;4-[[4-[benzyl(methyl)sulfamoyl]phenyl]methyl]-N-(1H-imidazol-2-ylmethyl)piperazine-1-carboxamide;N-[[3-[2-(diethylamino)ethoxy]phenyl]methyl]-4-[(3-morpholin-4-ylpropylamino)methyl]benzenesulfonamide;N-[4-[2-(diethylamino)ethoxy]phenyl]-4-(piperazin-1-ylmethyl)benzenesulfonamide is CCN(CC)CCOc1ccc(NS(=O)(=O)c2ccc(CN3CCNCC3)cc2)cc1.CCN(CC)CCOc1cccc(CNS(=O)(=O)c2ccc(CNCCCN3CCOCC3)cc2)c1.CN(Cc1ccccc1)S(=O)(=O)c1ccc(CN2CCN(C(=O)NCc3ccccc3)CC2)cc1.CN(Cc1ccccc1)S(=O)(=O)c1ccc(CN2CCN(C(=O)NCc3ncc[nH]3)CC2)cc1.CN(Cc1ccccc1)S(=O)(=O)c1ccc(CNCc2ccccn2)cc1.CN(Cc1ccccc1)S(=O)(=O)c1ccc(CNCc2ncc[nH]2)cc1.O=S(=O)(c1ccc(CN2CCNCC2)cc1)N(Cc1ccccc1)CC1CC1.O=S(=O)(c1ccc(CNC2CCCc3cccnc32)cc1)N(Cc1ccccc1)CC1CC1.
What is the InChIKey of N-benzyl-4-[[4-[benzyl(methyl)sulfamoyl]phenyl]methyl]piperazine-1-carboxamide;N-benzyl-N-(cyclopropylmethyl)-4-(piperazin-1-ylmethyl)benzenesulfonamide;N-benzyl-N-(cyclopropylmethyl)-4-[(5,6,7,8-tetrahydroquinolin-8-ylamino)methyl]benzenesulfonamide;N-benzyl-4-[(1H-imidazol-2-ylmethylamino)methyl]-N-methylbenzenesulfonamide;N-benzyl-N-methyl-4-[(pyridin-2-ylmethylamino)methyl]benzenesulfonamide;4-[[4-[benzyl(methyl)sulfamoyl]phenyl]methyl]-N-(1H-imidazol-2-ylmethyl)piperazine-1-carboxamide;N-[[3-[2-(diethylamino)ethoxy]phenyl]methyl]-4-[(3-morpholin-4-ylpropylamino)methyl]benzenesulfonamide;N-[4-[2-(diethylamino)ethoxy]phenyl]-4-(piperazin-1-ylmethyl)benzenesulfonamide?
The InChIKey is LNDWMURWMUYZDL-UHFFFAOYSA-N. The full InChI is InChI=1S/C27H42N4O4S.C27H32N4O3S.C27H31N3O2S.C24H30N6O3S.C23H34N4O3S.C22H29N3O2S.C21H23N3O2S.C19H22N4O2S/c1-3-30(4-2)17-20-35-26-8-5-7-25(21-26)23-29-36(32,33)27-11-9-24(10-12-27)22-28-13-6-14-31-15-18-34-19-16-31;1-29(21-24-10-6-3-7-11-24)35(33,34)26-14-12-25(13-15-26)22-30-16-18-31(19-17-30)27(32)28-20-23-8-4-2-5-9-23;31-33(32,30(20-23-11-12-23)19-22-6-2-1-3-7-22)25-15-13-21(14-16-25)18-29-26-10-4-8-24-9-5-17-28-27(24)26;1-28(18-20-5-3-2-4-6-20)34(32,33)22-9-7-21(8-10-22)19-29-13-15-30(16-14-29)24(31)27-17-23-25-11-12-26-23;1-3-26(4-2)17-18-30-22-9-7-21(8-10-22)25-31(28,29)23-11-5-20(6-12-23)19-27-15-13-24-14-16-27;26-28(27,25(18-21-6-7-21)17-19-4-2-1-3-5-19)22-10-8-20(9-11-22)16-24-14-12-23-13-15-24;1-24(17-19-7-3-2-4-8-19)27(25,26)21-12-10-18(11-13-21)15-22-16-20-9-5-6-14-23-20;1-23(15-17-5-3-2-4-6-17)26(24,25)18-9-7-16(8-10-18)13-20-14-19-21-11-12-22-19/h5,7-12,21,28-29H,3-4,6,13-20,22-23H2,1-2H3;2-15H,16-22H2,1H3,(H,28,32);1-3,5-7,9,13-17,23,26,29H,4,8,10-12,18-20H2;2-12H,13-19H2,1H3,(H,25,26)(H,27,31);5-12,24-25H,3-4,13-19H2,1-2H3;1-5,8-11,21,23H,6-7,12-18H2;2-14,22H,15-17H2,1H3;2-12,20H,13-15H2,1H3,(H,21,22).
What are the key properties of N-benzyl-4-[[4-[benzyl(methyl)sulfamoyl]phenyl]methyl]piperazine-1-carboxamide;N-benzyl-N-(cyclopropylmethyl)-4-(piperazin-1-ylmethyl)benzenesulfonamide;N-benzyl-N-(cyclopropylmethyl)-4-[(5,6,7,8-tetrahydroquinolin-8-ylamino)methyl]benzenesulfonamide;N-benzyl-4-[(1H-imidazol-2-ylmethylamino)methyl]-N-methylbenzenesulfonamide;N-benzyl-N-methyl-4-[(pyridin-2-ylmethylamino)methyl]benzenesulfonamide;4-[[4-[benzyl(methyl)sulfamoyl]phenyl]methyl]-N-(1H-imidazol-2-ylmethyl)piperazine-1-carboxamide;N-[[3-[2-(diethylamino)ethoxy]phenyl]methyl]-4-[(3-morpholin-4-ylpropylamino)methyl]benzenesulfonamide;N-[4-[2-(diethylamino)ethoxy]phenyl]-4-(piperazin-1-ylmethyl)benzenesulfonamide?
N-benzyl-4-[[4-[benzyl(methyl)sulfamoyl]phenyl]methyl]piperazine-1-carboxamide;N-benzyl-N-(cyclopropylmethyl)-4-(piperazin-1-ylmethyl)benzenesulfonamide;N-benzyl-N-(cyclopropylmethyl)-4-[(5,6,7,8-tetrahydroquinolin-8-ylamino)methyl]benzenesulfonamide;N-benzyl-4-[(1H-imidazol-2-ylmethylamino)methyl]-N-methylbenzenesulfonamide;N-benzyl-N-methyl-4-[(pyridin-2-ylmethylamino)methyl]benzenesulfonamide;4-[[4-[benzyl(methyl)sulfamoyl]phenyl]methyl]-N-(1H-imidazol-2-ylmethyl)piperazine-1-carboxamide;N-[[3-[2-(diethylamino)ethoxy]phenyl]methyl]-4-[(3-morpholin-4-ylpropylamino)methyl]benzenesulfonamide;N-[4-[2-(diethylamino)ethoxy]phenyl]-4-(piperazin-1-ylmethyl)benzenesulfonamide has a molecular weight of 3553.77 g/mol, XLogP of 24.36, 76 rotatable bonds, 12 hydrogen bond donors, and 38 hydrogen bond acceptors.
Where does this data come from?
All data for N-benzyl-4-[[4-[benzyl(methyl)sulfamoyl]phenyl]methyl]piperazine-1-carboxamide;N-benzyl-N-(cyclopropylmethyl)-4-(piperazin-1-ylmethyl)benzenesulfonamide;N-benzyl-N-(cyclopropylmethyl)-4-[(5,6,7,8-tetrahydroquinolin-8-ylamino)methyl]benzenesulfonamide;N-benzyl-4-[(1H-imidazol-2-ylmethylamino)methyl]-N-methylbenzenesulfonamide;N-benzyl-N-methyl-4-[(pyridin-2-ylmethylamino)methyl]benzenesulfonamide;4-[[4-[benzyl(methyl)sulfamoyl]phenyl]methyl]-N-(1H-imidazol-2-ylmethyl)piperazine-1-carboxamide;N-[[3-[2-(diethylamino)ethoxy]phenyl]methyl]-4-[(3-morpholin-4-ylpropylamino)methyl]benzenesulfonamide;N-[4-[2-(diethylamino)ethoxy]phenyl]-4-(piperazin-1-ylmethyl)benzenesulfonamide is sourced from PubChem (CID 159399547), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).