propyl 4-[2-[2-(aminomethyl)-1,5-dimethylpyrrol-3-yl]-4-chloroquinoline-7-carbonyl]piperazine-1-carboxylate;propyl (3S)-4-[4-chloro-2-(4-hydroxy-3-methylphenyl)quinoline-7-carbonyl]-3-methylpiperazine-1-carboxylate;propyl 4-[4-chloro-2-(1-methoxycarbonylpyrrol-3-yl)quinoline-7-carbonyl]piperazine-1-carboxylate;propyl 4-[4-chloro-2-[4-(2-methoxyethoxymethyl)phenyl]quinoline-7-carbonyl]piperazine-1-carboxylate;propyl 4-[4-chloro-2-(2-methyl-3H-benzimidazol-5-yl)quinoline-7-carbonyl]piperazine-1-carboxylate;propyl 4-(4-chloro-2-phenylquinoline-7-carbonyl)piperazine-1-carboxylate;propyl 4-(4-chloroquinoline-7-carbonyl)piperazine-1-carboxylate;sulfane

C171H187Cl7N26O26S — CID 159457770

IUPACpropyl 4-[2-[2-(aminomethyl)-1,5-dimethylpyrrol-3-yl]-4-chloroquinoline-7-carbonyl]piperazine-1-carboxylate;propyl (3S)-4-[4-chloro-2-(4-hydroxy-3-methylphenyl)quinoline-7-carbonyl]-3-methylpiperazine-1-carboxylate;propyl 4-[4-chloro-2-(1-methoxycarbonylpyrrol-3-yl)quinoline-7-carbonyl]piperazine-1-carboxylate;propyl 4-[4-chloro-2-[4-(2-methoxyethoxymethyl)phenyl]quinoline-7-carbonyl]piperazine-1-carboxylate;propyl 4-[4-chloro-2-(2-methyl-3H-benzimidazol-5-yl)quinoline-7-carbonyl]piperazine-1-carboxylate;propyl 4-(4-chloro-2-phenylquinoline-7-carbonyl)piperazine-1-carboxylate;propyl 4-(4-chloroquinoline-7-carbonyl)piperazine-1-carboxylate;sulfane
SMILESCCCOC(=O)N1CCN(C(=O)c2ccc3c(Cl)cc(-c4cc(C)n(C)c4CN)nc3c2)CC1.CCCOC(=O)N1CCN(C(=O)c2ccc3c(Cl)cc(-c4ccc(COCCOC)cc4)nc3c2)CC1.CCCOC(=O)N1CCN(C(=O)c2ccc3c(Cl)cc(-c4ccc(O)c(C)c4)nc3c2)[C@@H](C)C1.CCCOC(=O)N1CCN(C(=O)c2ccc3c(Cl)cc(-c4ccc5nc(C)[nH]c5c4)nc3c2)CC1.CCCOC(=O)N1CCN(C(=O)c2ccc3c(Cl)cc(-c4ccccc4)nc3c2)CC1.CCCOC(=O)N1CCN(C(=O)c2ccc3c(Cl)cc(-c4ccn(C(=O)OC)c4)nc3c2)CC1.CCCOC(=O)N1CCN(C(=O)c2ccc3c(Cl)ccnc3c2)CC1.S
InChIInChI=1S/C28H32ClN3O5.C26H26ClN5O3.C26H28ClN3O4.C25H30ClN5O3.C24H25ClN4O5.C24H24ClN3O3.C18H20ClN3O3.H2S/c1-3-14-37-28(34)32-12-10-31(11-13-32)27(33)22-8-9-23-24(29)18-25(30-26(23)17-22)21-6-4-20(5-7-21)19-36-16-15-35-2;1-3-12-35-26(34)32-10-8-31(9-11-32)25(33)18-4-6-19-20(27)15-22(30-23(19)14-18)17-5-7-21-24(13-17)29-16(2)28-21;1-4-11-34-26(33)29-9-10-30(17(3)15-29)25(32)19-5-7-20-21(27)14-22(28-23(20)13-19)18-6-8-24(31)16(2)12-18;1-4-11-34-25(33)31-9-7-30(8-10-31)24(32)17-5-6-18-20(26)14-22(28-21(18)13-17)19-12-16(2)29(3)23(19)15-27;1-3-12-34-24(32)28-10-8-27(9-11-28)22(30)16-4-5-18-19(25)14-20(26-21(18)13-16)17-6-7-29(15-17)23(31)33-2;1-2-14-31-24(30)28-12-10-27(11-13-28)23(29)18-8-9-19-20(25)16-21(26-22(19)15-18)17-6-4-3-5-7-17;1-2-11-25-18(24)22-9-7-21(8-10-22)17(23)13-3-4-14-15(19)5-6-20-16(14)12-13;/h4-9,17-18H,3,10-16,19H2,1-2H3;4-7,13-15H,3,8-12H2,1-2H3,(H,28,29);5-8,12-14,17,31H,4,9-11,15H2,1-3H3;5-6,12-14H,4,7-11,15,27H2,1-3H3;4-7,13-15H,3,8-12H2,1-2H3;3-9,15-16H,2,10-14H2,1H3;3-6,12H,2,7-11H2,1H3;1H2/t;;17-;;;;;/m..0...../s1
InChIKeyLUEWPNSXGLVQCN-OTWBJDLDSA-N
MW3302.77 g/mol
LogP31.73
Rot. Bonds33

About propyl 4-[2-[2-(aminomethyl)-1,5-dimethylpyrrol-3-yl]-4-chloroquinoline-7-carbonyl]piperazine-1-carboxylate;propyl (3S)-4-[4-chloro-2-(4-hydroxy-3-methylphenyl)quinoline-7-carbonyl]-3-methylpiperazine-1-carboxylate;propyl 4-[4-chloro-2-(1-methoxycarbonylpyrrol-3-yl)quinoline-7-carbonyl]piperazine-1-carboxylate;propyl 4-[4-chloro-2-[4-(2-methoxyethoxymethyl)phenyl]quinoline-7-carbonyl]piperazine-1-carboxylate;propyl 4-[4-chloro-2-(2-methyl-3H-benzimidazol-5-yl)quinoline-7-carbonyl]piperazine-1-carboxylate;propyl 4-(4-chloro-2-phenylquinoline-7-carbonyl)piperazine-1-carboxylate;propyl 4-(4-chloroquinoline-7-carbonyl)piperazine-1-carboxylate;sulfane

propyl 4-[2-[2-(aminomethyl)-1,5-dimethylpyrrol-3-yl]-4-chloroquinoline-7-carbonyl]piperazine-1-carboxylate;propyl (3S)-4-[4-chloro-2-(4-hydroxy-3-methylphenyl)quinoline-7-carbonyl]-3-methylpiperazine-1-carboxylate;propyl 4-[4-chloro-2-(1-methoxycarbonylpyrrol-3-yl)quinoline-7-carbonyl]piperazine-1-carboxylate;propyl 4-[4-chloro-2-[4-(2-methoxyethoxymethyl)phenyl]quinoline-7-carbonyl]piperazine-1-carboxylate;propyl 4-[4-chloro-2-(2-methyl-3H-benzimidazol-5-yl)quinoline-7-carbonyl]piperazine-1-carboxylate;propyl 4-(4-chloro-2-phenylquinoline-7-carbonyl)piperazine-1-carboxylate;propyl 4-(4-chloroquinoline-7-carbonyl)piperazine-1-carboxylate;sulfane (PubChem CID 159457770) has the molecular formula C171H187Cl7N26O26S and a molecular weight of 3302.77 g/mol. Its IUPAC name is propyl 4-[2-[2-(aminomethyl)-1,5-dimethylpyrrol-3-yl]-4-chloroquinoline-7-carbonyl]piperazine-1-carboxylate;propyl (3S)-4-[4-chloro-2-(4-hydroxy-3-methylphenyl)quinoline-7-carbonyl]-3-methylpiperazine-1-carboxylate;propyl 4-[4-chloro-2-(1-methoxycarbonylpyrrol-3-yl)quinoline-7-carbonyl]piperazine-1-carboxylate;propyl 4-[4-chloro-2-[4-(2-methoxyethoxymethyl)phenyl]quinoline-7-carbonyl]piperazine-1-carboxylate;propyl 4-[4-chloro-2-(2-methyl-3H-benzimidazol-5-yl)quinoline-7-carbonyl]piperazine-1-carboxylate;propyl 4-(4-chloro-2-phenylquinoline-7-carbonyl)piperazine-1-carboxylate;propyl 4-(4-chloroquinoline-7-carbonyl)piperazine-1-carboxylate;sulfane.

Molecular Properties

Compound Namepropyl 4-[2-[2-(aminomethyl)-1,5-dimethylpyrrol-3-yl]-4-chloroquinoline-7-carbonyl]piperazine-1-carboxylate;propyl (3S)-4-[4-chloro-2-(4-hydroxy-3-methylphenyl)quinoline-7-carbonyl]-3-methylpiperazine-1-carboxylate;propyl 4-[4-chloro-2-(1-methoxycarbonylpyrrol-3-yl)quinoline-7-carbonyl]piperazine-1-carboxylate;propyl 4-[4-chloro-2-[4-(2-methoxyethoxymethyl)phenyl]quinoline-7-carbonyl]piperazine-1-carboxylate;propyl 4-[4-chloro-2-(2-methyl-3H-benzimidazol-5-yl)quinoline-7-carbonyl]piperazine-1-carboxylate;propyl 4-(4-chloro-2-phenylquinoline-7-carbonyl)piperazine-1-carboxylate;propyl 4-(4-chloroquinoline-7-carbonyl)piperazine-1-carboxylate;sulfane
PubChem CID159457770
Molecular FormulaC171H187Cl7N26O26S
Molecular Weight3302.77 g/mol
Exact Mass3297.17
IUPAC Namepropyl 4-[2-[2-(aminomethyl)-1,5-dimethylpyrrol-3-yl]-4-chloroquinoline-7-carbonyl]piperazine-1-carboxylate;propyl (3S)-4-[4-chloro-2-(4-hydroxy-3-methylphenyl)quinoline-7-carbonyl]-3-methylpiperazine-1-carboxylate;propyl 4-[4-chloro-2-(1-methoxycarbonylpyrrol-3-yl)quinoline-7-carbonyl]piperazine-1-carboxylate;propyl 4-[4-chloro-2-[4-(2-methoxyethoxymethyl)phenyl]quinoline-7-carbonyl]piperazine-1-carboxylate;propyl 4-[4-chloro-2-(2-methyl-3H-benzimidazol-5-yl)quinoline-7-carbonyl]piperazine-1-carboxylate;propyl 4-(4-chloro-2-phenylquinoline-7-carbonyl)piperazine-1-carboxylate;propyl 4-(4-chloroquinoline-7-carbonyl)piperazine-1-carboxylate;sulfane
SMILESCCCOC(=O)N1CCN(C(=O)c2ccc3c(Cl)cc(-c4cc(C)n(C)c4CN)nc3c2)CC1.CCCOC(=O)N1CCN(C(=O)c2ccc3c(Cl)cc(-c4ccc(COCCOC)cc4)nc3c2)CC1.CCCOC(=O)N1CCN(C(=O)c2ccc3c(Cl)cc(-c4ccc(O)c(C)c4)nc3c2)[C@@H](C)C1.CCCOC(=O)N1CCN(C(=O)c2ccc3c(Cl)cc(-c4ccc5nc(C)[nH]c5c4)nc3c2)CC1.CCCOC(=O)N1CCN(C(=O)c2ccc3c(Cl)cc(-c4ccccc4)nc3c2)CC1.CCCOC(=O)N1CCN(C(=O)c2ccc3c(Cl)cc(-c4ccn(C(=O)OC)c4)nc3c2)CC1.CCCOC(=O)N1CCN(C(=O)c2ccc3c(Cl)ccnc3c2)CC1.S
InChIInChI=1S/C28H32ClN3O5.C26H26ClN5O3.C26H28ClN3O4.C25H30ClN5O3.C24H25ClN4O5.C24H24ClN3O3.C18H20ClN3O3.H2S/c1-3-14-37-28(34)32-12-10-31(11-13-32)27(33)22-8-9-23-24(29)18-25(30-26(23)17-22)21-6-4-20(5-7-21)19-36-16-15-35-2;1-3-12-35-26(34)32-10-8-31(9-11-32)25(33)18-4-6-19-20(27)15-22(30-23(19)14-18)17-5-7-21-24(13-17)29-16(2)28-21;1-4-11-34-26(33)29-9-10-30(17(3)15-29)25(32)19-5-7-20-21(27)14-22(28-23(20)13-19)18-6-8-24(31)16(2)12-18;1-4-11-34-25(33)31-9-7-30(8-10-31)24(32)17-5-6-18-20(26)14-22(28-21(18)13-17)19-12-16(2)29(3)23(19)15-27;1-3-12-34-24(32)28-10-8-27(9-11-28)22(30)16-4-5-18-19(25)14-20(26-21(18)13-16)17-6-7-29(15-17)23(31)33-2;1-2-14-31-24(30)28-12-10-27(11-13-28)23(29)18-8-9-19-20(25)16-21(26-22(19)15-18)17-6-4-3-5-7-17;1-2-11-25-18(24)22-9-7-21(8-10-22)17(23)13-3-4-14-15(19)5-6-20-16(14)12-13;/h4-9,17-18H,3,10-16,19H2,1-2H3;4-7,13-15H,3,8-12H2,1-2H3,(H,28,29);5-8,12-14,17,31H,4,9-11,15H2,1-3H3;5-6,12-14H,4,7-11,15,27H2,1-3H3;4-7,13-15H,3,8-12H2,1-2H3;3-9,15-16H,2,10-14H2,1H3;3-6,12H,2,7-11H2,1H3;1H2/t;;17-;;;;;/m..0...../s1
InChIKeyLUEWPNSXGLVQCN-OTWBJDLDSA-N
XLogP31.73
TPSA568.73 Ų
H-Bond Donors3
H-Bond Acceptors37
Rotatable Bonds33
Heavy Atoms231
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5003302.77
LogP ≤ 531.73
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 1037

Computed Properties (RDKit)

Structural Alerts{'alert_name': '>_2_ester_groups', 'substructure': 'N/A'}, {'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

Analyze propyl 4-[2-[2-(aminomethyl)-1,5-dimethylpyrrol-3-yl]-4-chloroquinoline-7-carbonyl]piperazine-1-carboxylate;propyl (3S)-4-[4-chloro-2-(4-hydroxy-3-methylphenyl)quinoline-7-carbonyl]-3-methylpiperazine-1-carboxylate;propyl 4-[4-chloro-2-(1-methoxycarbonylpyrrol-3-yl)quinoline-7-carbonyl]piperazine-1-carboxylate;propyl 4-[4-chloro-2-[4-(2-methoxyethoxymethyl)phenyl]quinoline-7-carbonyl]piperazine-1-carboxylate;propyl 4-[4-chloro-2-(2-methyl-3H-benzimidazol-5-yl)quinoline-7-carbonyl]piperazine-1-carboxylate;propyl 4-(4-chloro-2-phenylquinoline-7-carbonyl)piperazine-1-carboxylate;propyl 4-(4-chloroquinoline-7-carbonyl)piperazine-1-carboxylate;sulfane with MolForge

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Frequently Asked Questions

What is the IUPAC name of propyl 4-[2-[2-(aminomethyl)-1,5-dimethylpyrrol-3-yl]-4-chloroquinoline-7-carbonyl]piperazine-1-carboxylate;propyl (3S)-4-[4-chloro-2-(4-hydroxy-3-methylphenyl)quinoline-7-carbonyl]-3-methylpiperazine-1-carboxylate;propyl 4-[4-chloro-2-(1-methoxycarbonylpyrrol-3-yl)quinoline-7-carbonyl]piperazine-1-carboxylate;propyl 4-[4-chloro-2-[4-(2-methoxyethoxymethyl)phenyl]quinoline-7-carbonyl]piperazine-1-carboxylate;propyl 4-[4-chloro-2-(2-methyl-3H-benzimidazol-5-yl)quinoline-7-carbonyl]piperazine-1-carboxylate;propyl 4-(4-chloro-2-phenylquinoline-7-carbonyl)piperazine-1-carboxylate;propyl 4-(4-chloroquinoline-7-carbonyl)piperazine-1-carboxylate;sulfane?
The IUPAC name of propyl 4-[2-[2-(aminomethyl)-1,5-dimethylpyrrol-3-yl]-4-chloroquinoline-7-carbonyl]piperazine-1-carboxylate;propyl (3S)-4-[4-chloro-2-(4-hydroxy-3-methylphenyl)quinoline-7-carbonyl]-3-methylpiperazine-1-carboxylate;propyl 4-[4-chloro-2-(1-methoxycarbonylpyrrol-3-yl)quinoline-7-carbonyl]piperazine-1-carboxylate;propyl 4-[4-chloro-2-[4-(2-methoxyethoxymethyl)phenyl]quinoline-7-carbonyl]piperazine-1-carboxylate;propyl 4-[4-chloro-2-(2-methyl-3H-benzimidazol-5-yl)quinoline-7-carbonyl]piperazine-1-carboxylate;propyl 4-(4-chloro-2-phenylquinoline-7-carbonyl)piperazine-1-carboxylate;propyl 4-(4-chloroquinoline-7-carbonyl)piperazine-1-carboxylate;sulfane (CID 159457770) is propyl 4-[2-[2-(aminomethyl)-1,5-dimethylpyrrol-3-yl]-4-chloroquinoline-7-carbonyl]piperazine-1-carboxylate;propyl (3S)-4-[4-chloro-2-(4-hydroxy-3-methylphenyl)quinoline-7-carbonyl]-3-methylpiperazine-1-carboxylate;propyl 4-[4-chloro-2-(1-methoxycarbonylpyrrol-3-yl)quinoline-7-carbonyl]piperazine-1-carboxylate;propyl 4-[4-chloro-2-[4-(2-methoxyethoxymethyl)phenyl]quinoline-7-carbonyl]piperazine-1-carboxylate;propyl 4-[4-chloro-2-(2-methyl-3H-benzimidazol-5-yl)quinoline-7-carbonyl]piperazine-1-carboxylate;propyl 4-(4-chloro-2-phenylquinoline-7-carbonyl)piperazine-1-carboxylate;propyl 4-(4-chloroquinoline-7-carbonyl)piperazine-1-carboxylate;sulfane.
What is the SMILES notation for propyl 4-[2-[2-(aminomethyl)-1,5-dimethylpyrrol-3-yl]-4-chloroquinoline-7-carbonyl]piperazine-1-carboxylate;propyl (3S)-4-[4-chloro-2-(4-hydroxy-3-methylphenyl)quinoline-7-carbonyl]-3-methylpiperazine-1-carboxylate;propyl 4-[4-chloro-2-(1-methoxycarbonylpyrrol-3-yl)quinoline-7-carbonyl]piperazine-1-carboxylate;propyl 4-[4-chloro-2-[4-(2-methoxyethoxymethyl)phenyl]quinoline-7-carbonyl]piperazine-1-carboxylate;propyl 4-[4-chloro-2-(2-methyl-3H-benzimidazol-5-yl)quinoline-7-carbonyl]piperazine-1-carboxylate;propyl 4-(4-chloro-2-phenylquinoline-7-carbonyl)piperazine-1-carboxylate;propyl 4-(4-chloroquinoline-7-carbonyl)piperazine-1-carboxylate;sulfane?
The canonical SMILES for propyl 4-[2-[2-(aminomethyl)-1,5-dimethylpyrrol-3-yl]-4-chloroquinoline-7-carbonyl]piperazine-1-carboxylate;propyl (3S)-4-[4-chloro-2-(4-hydroxy-3-methylphenyl)quinoline-7-carbonyl]-3-methylpiperazine-1-carboxylate;propyl 4-[4-chloro-2-(1-methoxycarbonylpyrrol-3-yl)quinoline-7-carbonyl]piperazine-1-carboxylate;propyl 4-[4-chloro-2-[4-(2-methoxyethoxymethyl)phenyl]quinoline-7-carbonyl]piperazine-1-carboxylate;propyl 4-[4-chloro-2-(2-methyl-3H-benzimidazol-5-yl)quinoline-7-carbonyl]piperazine-1-carboxylate;propyl 4-(4-chloro-2-phenylquinoline-7-carbonyl)piperazine-1-carboxylate;propyl 4-(4-chloroquinoline-7-carbonyl)piperazine-1-carboxylate;sulfane is CCCOC(=O)N1CCN(C(=O)c2ccc3c(Cl)cc(-c4cc(C)n(C)c4CN)nc3c2)CC1.CCCOC(=O)N1CCN(C(=O)c2ccc3c(Cl)cc(-c4ccc(COCCOC)cc4)nc3c2)CC1.CCCOC(=O)N1CCN(C(=O)c2ccc3c(Cl)cc(-c4ccc(O)c(C)c4)nc3c2)[C@@H](C)C1.CCCOC(=O)N1CCN(C(=O)c2ccc3c(Cl)cc(-c4ccc5nc(C)[nH]c5c4)nc3c2)CC1.CCCOC(=O)N1CCN(C(=O)c2ccc3c(Cl)cc(-c4ccccc4)nc3c2)CC1.CCCOC(=O)N1CCN(C(=O)c2ccc3c(Cl)cc(-c4ccn(C(=O)OC)c4)nc3c2)CC1.CCCOC(=O)N1CCN(C(=O)c2ccc3c(Cl)ccnc3c2)CC1.S.
What is the InChIKey of propyl 4-[2-[2-(aminomethyl)-1,5-dimethylpyrrol-3-yl]-4-chloroquinoline-7-carbonyl]piperazine-1-carboxylate;propyl (3S)-4-[4-chloro-2-(4-hydroxy-3-methylphenyl)quinoline-7-carbonyl]-3-methylpiperazine-1-carboxylate;propyl 4-[4-chloro-2-(1-methoxycarbonylpyrrol-3-yl)quinoline-7-carbonyl]piperazine-1-carboxylate;propyl 4-[4-chloro-2-[4-(2-methoxyethoxymethyl)phenyl]quinoline-7-carbonyl]piperazine-1-carboxylate;propyl 4-[4-chloro-2-(2-methyl-3H-benzimidazol-5-yl)quinoline-7-carbonyl]piperazine-1-carboxylate;propyl 4-(4-chloro-2-phenylquinoline-7-carbonyl)piperazine-1-carboxylate;propyl 4-(4-chloroquinoline-7-carbonyl)piperazine-1-carboxylate;sulfane?
The InChIKey is LUEWPNSXGLVQCN-OTWBJDLDSA-N. The full InChI is InChI=1S/C28H32ClN3O5.C26H26ClN5O3.C26H28ClN3O4.C25H30ClN5O3.C24H25ClN4O5.C24H24ClN3O3.C18H20ClN3O3.H2S/c1-3-14-37-28(34)32-12-10-31(11-13-32)27(33)22-8-9-23-24(29)18-25(30-26(23)17-22)21-6-4-20(5-7-21)19-36-16-15-35-2;1-3-12-35-26(34)32-10-8-31(9-11-32)25(33)18-4-6-19-20(27)15-22(30-23(19)14-18)17-5-7-21-24(13-17)29-16(2)28-21;1-4-11-34-26(33)29-9-10-30(17(3)15-29)25(32)19-5-7-20-21(27)14-22(28-23(20)13-19)18-6-8-24(31)16(2)12-18;1-4-11-34-25(33)31-9-7-30(8-10-31)24(32)17-5-6-18-20(26)14-22(28-21(18)13-17)19-12-16(2)29(3)23(19)15-27;1-3-12-34-24(32)28-10-8-27(9-11-28)22(30)16-4-5-18-19(25)14-20(26-21(18)13-16)17-6-7-29(15-17)23(31)33-2;1-2-14-31-24(30)28-12-10-27(11-13-28)23(29)18-8-9-19-20(25)16-21(26-22(19)15-18)17-6-4-3-5-7-17;1-2-11-25-18(24)22-9-7-21(8-10-22)17(23)13-3-4-14-15(19)5-6-20-16(14)12-13;/h4-9,17-18H,3,10-16,19H2,1-2H3;4-7,13-15H,3,8-12H2,1-2H3,(H,28,29);5-8,12-14,17,31H,4,9-11,15H2,1-3H3;5-6,12-14H,4,7-11,15,27H2,1-3H3;4-7,13-15H,3,8-12H2,1-2H3;3-9,15-16H,2,10-14H2,1H3;3-6,12H,2,7-11H2,1H3;1H2/t;;17-;;;;;/m..0...../s1.
What are the key properties of propyl 4-[2-[2-(aminomethyl)-1,5-dimethylpyrrol-3-yl]-4-chloroquinoline-7-carbonyl]piperazine-1-carboxylate;propyl (3S)-4-[4-chloro-2-(4-hydroxy-3-methylphenyl)quinoline-7-carbonyl]-3-methylpiperazine-1-carboxylate;propyl 4-[4-chloro-2-(1-methoxycarbonylpyrrol-3-yl)quinoline-7-carbonyl]piperazine-1-carboxylate;propyl 4-[4-chloro-2-[4-(2-methoxyethoxymethyl)phenyl]quinoline-7-carbonyl]piperazine-1-carboxylate;propyl 4-[4-chloro-2-(2-methyl-3H-benzimidazol-5-yl)quinoline-7-carbonyl]piperazine-1-carboxylate;propyl 4-(4-chloro-2-phenylquinoline-7-carbonyl)piperazine-1-carboxylate;propyl 4-(4-chloroquinoline-7-carbonyl)piperazine-1-carboxylate;sulfane?
propyl 4-[2-[2-(aminomethyl)-1,5-dimethylpyrrol-3-yl]-4-chloroquinoline-7-carbonyl]piperazine-1-carboxylate;propyl (3S)-4-[4-chloro-2-(4-hydroxy-3-methylphenyl)quinoline-7-carbonyl]-3-methylpiperazine-1-carboxylate;propyl 4-[4-chloro-2-(1-methoxycarbonylpyrrol-3-yl)quinoline-7-carbonyl]piperazine-1-carboxylate;propyl 4-[4-chloro-2-[4-(2-methoxyethoxymethyl)phenyl]quinoline-7-carbonyl]piperazine-1-carboxylate;propyl 4-[4-chloro-2-(2-methyl-3H-benzimidazol-5-yl)quinoline-7-carbonyl]piperazine-1-carboxylate;propyl 4-(4-chloro-2-phenylquinoline-7-carbonyl)piperazine-1-carboxylate;propyl 4-(4-chloroquinoline-7-carbonyl)piperazine-1-carboxylate;sulfane has a molecular weight of 3302.77 g/mol, XLogP of 31.73, 33 rotatable bonds, 3 hydrogen bond donors, and 37 hydrogen bond acceptors.
Where does this data come from?
All data for propyl 4-[2-[2-(aminomethyl)-1,5-dimethylpyrrol-3-yl]-4-chloroquinoline-7-carbonyl]piperazine-1-carboxylate;propyl (3S)-4-[4-chloro-2-(4-hydroxy-3-methylphenyl)quinoline-7-carbonyl]-3-methylpiperazine-1-carboxylate;propyl 4-[4-chloro-2-(1-methoxycarbonylpyrrol-3-yl)quinoline-7-carbonyl]piperazine-1-carboxylate;propyl 4-[4-chloro-2-[4-(2-methoxyethoxymethyl)phenyl]quinoline-7-carbonyl]piperazine-1-carboxylate;propyl 4-[4-chloro-2-(2-methyl-3H-benzimidazol-5-yl)quinoline-7-carbonyl]piperazine-1-carboxylate;propyl 4-(4-chloro-2-phenylquinoline-7-carbonyl)piperazine-1-carboxylate;propyl 4-(4-chloroquinoline-7-carbonyl)piperazine-1-carboxylate;sulfane is sourced from PubChem (CID 159457770), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).