(5Z)-5-[[3-chloro-4-(4-cyclohexylbutoxy)phenyl]methylidene]thiolane-2,4-dione;(5Z)-5-[[2-chloro-3-(2-cyclohexylethoxy)phenyl]methylidene]thiolane-2,4-dione;(5Z)-5-[[2-chloro-3-(cyclohexylmethoxy)phenyl]methylidene]thiolane-2,4-dione;(5Z)-5-[[2-chloro-3-(3-cyclohexylpropoxy)phenyl]methylidene]thiolane-2,4-dione;(5Z)-5-[(3-chloro-4-phenylmethoxyphenyl)methylidene]thiolane-2,4-dione;(5Z)-5-[[4-(2-cyclohexylethoxy)-3-nitrophenyl]methylidene]thiolane-2,4-dione;(5Z)-5-[[4-(cyclohexylmethoxy)-3-methylphenyl]methylidene]thiolane-2,4-dione;(5Z)-5-[[4-(cyclopentylmethoxy)phenyl]methylidene]thiolane-2,4-dione;(5Z)-5-[[3-methyl-4-[(4-methylcyclohexyl)methoxy]phenyl]methylidene]thiolane-2,4-dione

C171H186Cl5NO29S9 — CID 162232959

IUPAC(5Z)-5-[[3-chloro-4-(4-cyclohexylbutoxy)phenyl]methylidene]thiolane-2,4-dione;(5Z)-5-[[2-chloro-3-(2-cyclohexylethoxy)phenyl]methylidene]thiolane-2,4-dione;(5Z)-5-[[2-chloro-3-(cyclohexylmethoxy)phenyl]methylidene]thiolane-2,4-dione;(5Z)-5-[[2-chloro-3-(3-cyclohexylpropoxy)phenyl]methylidene]thiolane-2,4-dione;(5Z)-5-[(3-chloro-4-phenylmethoxyphenyl)methylidene]thiolane-2,4-dione;(5Z)-5-[[4-(2-cyclohexylethoxy)-3-nitrophenyl]methylidene]thiolane-2,4-dione;(5Z)-5-[[4-(cyclohexylmethoxy)-3-methylphenyl]methylidene]thiolane-2,4-dione;(5Z)-5-[[4-(cyclopentylmethoxy)phenyl]methylidene]thiolane-2,4-dione;(5Z)-5-[[3-methyl-4-[(4-methylcyclohexyl)methoxy]phenyl]methylidene]thiolane-2,4-dione
SMILESCc1cc(/C=C2\SC(=O)CC2=O)ccc1OCC1CCC(C)CC1.Cc1cc(/C=C2\SC(=O)CC2=O)ccc1OCC1CCCCC1.O=C1CC(=O)/C(=C/c2ccc(OCC3CCCC3)cc2)S1.O=C1CC(=O)/C(=C/c2ccc(OCCC3CCCCC3)c([N+](=O)[O-])c2)S1.O=C1CC(=O)/C(=C/c2ccc(OCCCCC3CCCCC3)c(Cl)c2)S1.O=C1CC(=O)/C(=C/c2ccc(OCc3ccccc3)c(Cl)c2)S1.O=C1CC(=O)/C(=C/c2cccc(OCC3CCCCC3)c2Cl)S1.O=C1CC(=O)/C(=C/c2cccc(OCCC3CCCCC3)c2Cl)S1.O=C1CC(=O)/C(=C/c2cccc(OCCCC3CCCCC3)c2Cl)S1
InChIInChI=1S/C21H25ClO3S.C20H23ClO3S.C20H24O3S.C19H21ClO3S.C19H21NO5S.C19H22O3S.C18H19ClO3S.C18H13ClO3S.C17H18O3S/c22-17-12-16(13-20-18(23)14-21(24)26-20)9-10-19(17)25-11-5-4-8-15-6-2-1-3-7-15;21-20-15(12-18-16(22)13-19(23)25-18)9-4-10-17(20)24-11-5-8-14-6-2-1-3-7-14;1-13-3-5-15(6-4-13)12-23-18-8-7-16(9-14(18)2)10-19-17(21)11-20(22)24-19;20-19-14(11-17-15(21)12-18(22)24-17)7-4-8-16(19)23-10-9-13-5-2-1-3-6-13;21-16-12-19(22)26-18(16)11-14-6-7-17(15(10-14)20(23)24)25-9-8-13-4-2-1-3-5-13;1-13-9-15(10-18-16(20)11-19(21)23-18)7-8-17(13)22-12-14-5-3-2-4-6-14;19-18-13(9-16-14(20)10-17(21)23-16)7-4-8-15(18)22-11-12-5-2-1-3-6-12;19-14-8-13(9-17-15(20)10-18(21)23-17)6-7-16(14)22-11-12-4-2-1-3-5-12;18-15-10-17(19)21-16(15)9-12-5-7-14(8-6-12)20-11-13-3-1-2-4-13/h9-10,12-13,15H,1-8,11,14H2;4,9-10,12,14H,1-3,5-8,11,13H2;7-10,13,15H,3-6,11-12H2,1-2H3;4,7-8,11,13H,1-3,5-6,9-10,12H2;6-7,10-11,13H,1-5,8-9,12H2;7-10,14H,2-6,11-12H2,1H3;4,7-9,12H,1-3,5-6,10-11H2;1-9H,10-11H2;5-9,13H,1-4,10-11H2/b20-13-;18-12-;19-10-;17-11-;18-11-;18-10-;16-9-;17-9-;16-9-
InChIKeyZVRHNIAKNDBVTC-DRYMUCKBSA-N
MW3185.21 g/mol
LogP43.97
Rot. Bonds44

About (5Z)-5-[[3-chloro-4-(4-cyclohexylbutoxy)phenyl]methylidene]thiolane-2,4-dione;(5Z)-5-[[2-chloro-3-(2-cyclohexylethoxy)phenyl]methylidene]thiolane-2,4-dione;(5Z)-5-[[2-chloro-3-(cyclohexylmethoxy)phenyl]methylidene]thiolane-2,4-dione;(5Z)-5-[[2-chloro-3-(3-cyclohexylpropoxy)phenyl]methylidene]thiolane-2,4-dione;(5Z)-5-[(3-chloro-4-phenylmethoxyphenyl)methylidene]thiolane-2,4-dione;(5Z)-5-[[4-(2-cyclohexylethoxy)-3-nitrophenyl]methylidene]thiolane-2,4-dione;(5Z)-5-[[4-(cyclohexylmethoxy)-3-methylphenyl]methylidene]thiolane-2,4-dione;(5Z)-5-[[4-(cyclopentylmethoxy)phenyl]methylidene]thiolane-2,4-dione;(5Z)-5-[[3-methyl-4-[(4-methylcyclohexyl)methoxy]phenyl]methylidene]thiolane-2,4-dione

(5Z)-5-[[3-chloro-4-(4-cyclohexylbutoxy)phenyl]methylidene]thiolane-2,4-dione;(5Z)-5-[[2-chloro-3-(2-cyclohexylethoxy)phenyl]methylidene]thiolane-2,4-dione;(5Z)-5-[[2-chloro-3-(cyclohexylmethoxy)phenyl]methylidene]thiolane-2,4-dione;(5Z)-5-[[2-chloro-3-(3-cyclohexylpropoxy)phenyl]methylidene]thiolane-2,4-dione;(5Z)-5-[(3-chloro-4-phenylmethoxyphenyl)methylidene]thiolane-2,4-dione;(5Z)-5-[[4-(2-cyclohexylethoxy)-3-nitrophenyl]methylidene]thiolane-2,4-dione;(5Z)-5-[[4-(cyclohexylmethoxy)-3-methylphenyl]methylidene]thiolane-2,4-dione;(5Z)-5-[[4-(cyclopentylmethoxy)phenyl]methylidene]thiolane-2,4-dione;(5Z)-5-[[3-methyl-4-[(4-methylcyclohexyl)methoxy]phenyl]methylidene]thiolane-2,4-dione (PubChem CID 162232959) has the molecular formula C171H186Cl5NO29S9 and a molecular weight of 3185.21 g/mol. Its IUPAC name is (5Z)-5-[[3-chloro-4-(4-cyclohexylbutoxy)phenyl]methylidene]thiolane-2,4-dione;(5Z)-5-[[2-chloro-3-(2-cyclohexylethoxy)phenyl]methylidene]thiolane-2,4-dione;(5Z)-5-[[2-chloro-3-(cyclohexylmethoxy)phenyl]methylidene]thiolane-2,4-dione;(5Z)-5-[[2-chloro-3-(3-cyclohexylpropoxy)phenyl]methylidene]thiolane-2,4-dione;(5Z)-5-[(3-chloro-4-phenylmethoxyphenyl)methylidene]thiolane-2,4-dione;(5Z)-5-[[4-(2-cyclohexylethoxy)-3-nitrophenyl]methylidene]thiolane-2,4-dione;(5Z)-5-[[4-(cyclohexylmethoxy)-3-methylphenyl]methylidene]thiolane-2,4-dione;(5Z)-5-[[4-(cyclopentylmethoxy)phenyl]methylidene]thiolane-2,4-dione;(5Z)-5-[[3-methyl-4-[(4-methylcyclohexyl)methoxy]phenyl]methylidene]thiolane-2,4-dione.

Molecular Properties

Compound Name(5Z)-5-[[3-chloro-4-(4-cyclohexylbutoxy)phenyl]methylidene]thiolane-2,4-dione;(5Z)-5-[[2-chloro-3-(2-cyclohexylethoxy)phenyl]methylidene]thiolane-2,4-dione;(5Z)-5-[[2-chloro-3-(cyclohexylmethoxy)phenyl]methylidene]thiolane-2,4-dione;(5Z)-5-[[2-chloro-3-(3-cyclohexylpropoxy)phenyl]methylidene]thiolane-2,4-dione;(5Z)-5-[(3-chloro-4-phenylmethoxyphenyl)methylidene]thiolane-2,4-dione;(5Z)-5-[[4-(2-cyclohexylethoxy)-3-nitrophenyl]methylidene]thiolane-2,4-dione;(5Z)-5-[[4-(cyclohexylmethoxy)-3-methylphenyl]methylidene]thiolane-2,4-dione;(5Z)-5-[[4-(cyclopentylmethoxy)phenyl]methylidene]thiolane-2,4-dione;(5Z)-5-[[3-methyl-4-[(4-methylcyclohexyl)methoxy]phenyl]methylidene]thiolane-2,4-dione
PubChem CID162232959
Molecular FormulaC171H186Cl5NO29S9
Molecular Weight3185.21 g/mol
Exact Mass3179.90
IUPAC Name(5Z)-5-[[3-chloro-4-(4-cyclohexylbutoxy)phenyl]methylidene]thiolane-2,4-dione;(5Z)-5-[[2-chloro-3-(2-cyclohexylethoxy)phenyl]methylidene]thiolane-2,4-dione;(5Z)-5-[[2-chloro-3-(cyclohexylmethoxy)phenyl]methylidene]thiolane-2,4-dione;(5Z)-5-[[2-chloro-3-(3-cyclohexylpropoxy)phenyl]methylidene]thiolane-2,4-dione;(5Z)-5-[(3-chloro-4-phenylmethoxyphenyl)methylidene]thiolane-2,4-dione;(5Z)-5-[[4-(2-cyclohexylethoxy)-3-nitrophenyl]methylidene]thiolane-2,4-dione;(5Z)-5-[[4-(cyclohexylmethoxy)-3-methylphenyl]methylidene]thiolane-2,4-dione;(5Z)-5-[[4-(cyclopentylmethoxy)phenyl]methylidene]thiolane-2,4-dione;(5Z)-5-[[3-methyl-4-[(4-methylcyclohexyl)methoxy]phenyl]methylidene]thiolane-2,4-dione
SMILESCc1cc(/C=C2\SC(=O)CC2=O)ccc1OCC1CCC(C)CC1.Cc1cc(/C=C2\SC(=O)CC2=O)ccc1OCC1CCCCC1.O=C1CC(=O)/C(=C/c2ccc(OCC3CCCC3)cc2)S1.O=C1CC(=O)/C(=C/c2ccc(OCCC3CCCCC3)c([N+](=O)[O-])c2)S1.O=C1CC(=O)/C(=C/c2ccc(OCCCCC3CCCCC3)c(Cl)c2)S1.O=C1CC(=O)/C(=C/c2ccc(OCc3ccccc3)c(Cl)c2)S1.O=C1CC(=O)/C(=C/c2cccc(OCC3CCCCC3)c2Cl)S1.O=C1CC(=O)/C(=C/c2cccc(OCCC3CCCCC3)c2Cl)S1.O=C1CC(=O)/C(=C/c2cccc(OCCCC3CCCCC3)c2Cl)S1
InChIInChI=1S/C21H25ClO3S.C20H23ClO3S.C20H24O3S.C19H21ClO3S.C19H21NO5S.C19H22O3S.C18H19ClO3S.C18H13ClO3S.C17H18O3S/c22-17-12-16(13-20-18(23)14-21(24)26-20)9-10-19(17)25-11-5-4-8-15-6-2-1-3-7-15;21-20-15(12-18-16(22)13-19(23)25-18)9-4-10-17(20)24-11-5-8-14-6-2-1-3-7-14;1-13-3-5-15(6-4-13)12-23-18-8-7-16(9-14(18)2)10-19-17(21)11-20(22)24-19;20-19-14(11-17-15(21)12-18(22)24-17)7-4-8-16(19)23-10-9-13-5-2-1-3-6-13;21-16-12-19(22)26-18(16)11-14-6-7-17(15(10-14)20(23)24)25-9-8-13-4-2-1-3-5-13;1-13-9-15(10-18-16(20)11-19(21)23-18)7-8-17(13)22-12-14-5-3-2-4-6-14;19-18-13(9-16-14(20)10-17(21)23-16)7-4-8-15(18)22-11-12-5-2-1-3-6-12;19-14-8-13(9-17-15(20)10-18(21)23-17)6-7-16(14)22-11-12-4-2-1-3-5-12;18-15-10-17(19)21-16(15)9-12-5-7-14(8-6-12)20-11-13-3-1-2-4-13/h9-10,12-13,15H,1-8,11,14H2;4,9-10,12,14H,1-3,5-8,11,13H2;7-10,13,15H,3-6,11-12H2,1-2H3;4,7-8,11,13H,1-3,5-6,9-10,12H2;6-7,10-11,13H,1-5,8-9,12H2;7-10,14H,2-6,11-12H2,1H3;4,7-9,12H,1-3,5-6,10-11H2;1-9H,10-11H2;5-9,13H,1-4,10-11H2/b20-13-;18-12-;19-10-;17-11-;18-11-;18-10-;16-9-;17-9-;16-9-
InChIKeyZVRHNIAKNDBVTC-DRYMUCKBSA-N
XLogP43.97
TPSA433.47 Ų
H-Bond Donors
H-Bond Acceptors38
Rotatable Bonds44
Heavy Atoms215
Complexity

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5003185.21
LogP ≤ 543.97
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1038

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'beta-keto/anhydride', 'substructure': 'N/A'}, {'alert_name': 'Michael_acceptor_1', 'substructure': 'N/A'}, {'alert_name': 'nitro_group', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

Analyze (5Z)-5-[[3-chloro-4-(4-cyclohexylbutoxy)phenyl]methylidene]thiolane-2,4-dione;(5Z)-5-[[2-chloro-3-(2-cyclohexylethoxy)phenyl]methylidene]thiolane-2,4-dione;(5Z)-5-[[2-chloro-3-(cyclohexylmethoxy)phenyl]methylidene]thiolane-2,4-dione;(5Z)-5-[[2-chloro-3-(3-cyclohexylpropoxy)phenyl]methylidene]thiolane-2,4-dione;(5Z)-5-[(3-chloro-4-phenylmethoxyphenyl)methylidene]thiolane-2,4-dione;(5Z)-5-[[4-(2-cyclohexylethoxy)-3-nitrophenyl]methylidene]thiolane-2,4-dione;(5Z)-5-[[4-(cyclohexylmethoxy)-3-methylphenyl]methylidene]thiolane-2,4-dione;(5Z)-5-[[4-(cyclopentylmethoxy)phenyl]methylidene]thiolane-2,4-dione;(5Z)-5-[[3-methyl-4-[(4-methylcyclohexyl)methoxy]phenyl]methylidene]thiolane-2,4-dione with MolForge

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Frequently Asked Questions

What is the IUPAC name of (5Z)-5-[[3-chloro-4-(4-cyclohexylbutoxy)phenyl]methylidene]thiolane-2,4-dione;(5Z)-5-[[2-chloro-3-(2-cyclohexylethoxy)phenyl]methylidene]thiolane-2,4-dione;(5Z)-5-[[2-chloro-3-(cyclohexylmethoxy)phenyl]methylidene]thiolane-2,4-dione;(5Z)-5-[[2-chloro-3-(3-cyclohexylpropoxy)phenyl]methylidene]thiolane-2,4-dione;(5Z)-5-[(3-chloro-4-phenylmethoxyphenyl)methylidene]thiolane-2,4-dione;(5Z)-5-[[4-(2-cyclohexylethoxy)-3-nitrophenyl]methylidene]thiolane-2,4-dione;(5Z)-5-[[4-(cyclohexylmethoxy)-3-methylphenyl]methylidene]thiolane-2,4-dione;(5Z)-5-[[4-(cyclopentylmethoxy)phenyl]methylidene]thiolane-2,4-dione;(5Z)-5-[[3-methyl-4-[(4-methylcyclohexyl)methoxy]phenyl]methylidene]thiolane-2,4-dione?
The IUPAC name of (5Z)-5-[[3-chloro-4-(4-cyclohexylbutoxy)phenyl]methylidene]thiolane-2,4-dione;(5Z)-5-[[2-chloro-3-(2-cyclohexylethoxy)phenyl]methylidene]thiolane-2,4-dione;(5Z)-5-[[2-chloro-3-(cyclohexylmethoxy)phenyl]methylidene]thiolane-2,4-dione;(5Z)-5-[[2-chloro-3-(3-cyclohexylpropoxy)phenyl]methylidene]thiolane-2,4-dione;(5Z)-5-[(3-chloro-4-phenylmethoxyphenyl)methylidene]thiolane-2,4-dione;(5Z)-5-[[4-(2-cyclohexylethoxy)-3-nitrophenyl]methylidene]thiolane-2,4-dione;(5Z)-5-[[4-(cyclohexylmethoxy)-3-methylphenyl]methylidene]thiolane-2,4-dione;(5Z)-5-[[4-(cyclopentylmethoxy)phenyl]methylidene]thiolane-2,4-dione;(5Z)-5-[[3-methyl-4-[(4-methylcyclohexyl)methoxy]phenyl]methylidene]thiolane-2,4-dione (CID 162232959) is (5Z)-5-[[3-chloro-4-(4-cyclohexylbutoxy)phenyl]methylidene]thiolane-2,4-dione;(5Z)-5-[[2-chloro-3-(2-cyclohexylethoxy)phenyl]methylidene]thiolane-2,4-dione;(5Z)-5-[[2-chloro-3-(cyclohexylmethoxy)phenyl]methylidene]thiolane-2,4-dione;(5Z)-5-[[2-chloro-3-(3-cyclohexylpropoxy)phenyl]methylidene]thiolane-2,4-dione;(5Z)-5-[(3-chloro-4-phenylmethoxyphenyl)methylidene]thiolane-2,4-dione;(5Z)-5-[[4-(2-cyclohexylethoxy)-3-nitrophenyl]methylidene]thiolane-2,4-dione;(5Z)-5-[[4-(cyclohexylmethoxy)-3-methylphenyl]methylidene]thiolane-2,4-dione;(5Z)-5-[[4-(cyclopentylmethoxy)phenyl]methylidene]thiolane-2,4-dione;(5Z)-5-[[3-methyl-4-[(4-methylcyclohexyl)methoxy]phenyl]methylidene]thiolane-2,4-dione.
What is the SMILES notation for (5Z)-5-[[3-chloro-4-(4-cyclohexylbutoxy)phenyl]methylidene]thiolane-2,4-dione;(5Z)-5-[[2-chloro-3-(2-cyclohexylethoxy)phenyl]methylidene]thiolane-2,4-dione;(5Z)-5-[[2-chloro-3-(cyclohexylmethoxy)phenyl]methylidene]thiolane-2,4-dione;(5Z)-5-[[2-chloro-3-(3-cyclohexylpropoxy)phenyl]methylidene]thiolane-2,4-dione;(5Z)-5-[(3-chloro-4-phenylmethoxyphenyl)methylidene]thiolane-2,4-dione;(5Z)-5-[[4-(2-cyclohexylethoxy)-3-nitrophenyl]methylidene]thiolane-2,4-dione;(5Z)-5-[[4-(cyclohexylmethoxy)-3-methylphenyl]methylidene]thiolane-2,4-dione;(5Z)-5-[[4-(cyclopentylmethoxy)phenyl]methylidene]thiolane-2,4-dione;(5Z)-5-[[3-methyl-4-[(4-methylcyclohexyl)methoxy]phenyl]methylidene]thiolane-2,4-dione?
The canonical SMILES for (5Z)-5-[[3-chloro-4-(4-cyclohexylbutoxy)phenyl]methylidene]thiolane-2,4-dione;(5Z)-5-[[2-chloro-3-(2-cyclohexylethoxy)phenyl]methylidene]thiolane-2,4-dione;(5Z)-5-[[2-chloro-3-(cyclohexylmethoxy)phenyl]methylidene]thiolane-2,4-dione;(5Z)-5-[[2-chloro-3-(3-cyclohexylpropoxy)phenyl]methylidene]thiolane-2,4-dione;(5Z)-5-[(3-chloro-4-phenylmethoxyphenyl)methylidene]thiolane-2,4-dione;(5Z)-5-[[4-(2-cyclohexylethoxy)-3-nitrophenyl]methylidene]thiolane-2,4-dione;(5Z)-5-[[4-(cyclohexylmethoxy)-3-methylphenyl]methylidene]thiolane-2,4-dione;(5Z)-5-[[4-(cyclopentylmethoxy)phenyl]methylidene]thiolane-2,4-dione;(5Z)-5-[[3-methyl-4-[(4-methylcyclohexyl)methoxy]phenyl]methylidene]thiolane-2,4-dione is Cc1cc(/C=C2\SC(=O)CC2=O)ccc1OCC1CCC(C)CC1.Cc1cc(/C=C2\SC(=O)CC2=O)ccc1OCC1CCCCC1.O=C1CC(=O)/C(=C/c2ccc(OCC3CCCC3)cc2)S1.O=C1CC(=O)/C(=C/c2ccc(OCCC3CCCCC3)c([N+](=O)[O-])c2)S1.O=C1CC(=O)/C(=C/c2ccc(OCCCCC3CCCCC3)c(Cl)c2)S1.O=C1CC(=O)/C(=C/c2ccc(OCc3ccccc3)c(Cl)c2)S1.O=C1CC(=O)/C(=C/c2cccc(OCC3CCCCC3)c2Cl)S1.O=C1CC(=O)/C(=C/c2cccc(OCCC3CCCCC3)c2Cl)S1.O=C1CC(=O)/C(=C/c2cccc(OCCCC3CCCCC3)c2Cl)S1.
What is the InChIKey of (5Z)-5-[[3-chloro-4-(4-cyclohexylbutoxy)phenyl]methylidene]thiolane-2,4-dione;(5Z)-5-[[2-chloro-3-(2-cyclohexylethoxy)phenyl]methylidene]thiolane-2,4-dione;(5Z)-5-[[2-chloro-3-(cyclohexylmethoxy)phenyl]methylidene]thiolane-2,4-dione;(5Z)-5-[[2-chloro-3-(3-cyclohexylpropoxy)phenyl]methylidene]thiolane-2,4-dione;(5Z)-5-[(3-chloro-4-phenylmethoxyphenyl)methylidene]thiolane-2,4-dione;(5Z)-5-[[4-(2-cyclohexylethoxy)-3-nitrophenyl]methylidene]thiolane-2,4-dione;(5Z)-5-[[4-(cyclohexylmethoxy)-3-methylphenyl]methylidene]thiolane-2,4-dione;(5Z)-5-[[4-(cyclopentylmethoxy)phenyl]methylidene]thiolane-2,4-dione;(5Z)-5-[[3-methyl-4-[(4-methylcyclohexyl)methoxy]phenyl]methylidene]thiolane-2,4-dione?
The InChIKey is ZVRHNIAKNDBVTC-DRYMUCKBSA-N. The full InChI is InChI=1S/C21H25ClO3S.C20H23ClO3S.C20H24O3S.C19H21ClO3S.C19H21NO5S.C19H22O3S.C18H19ClO3S.C18H13ClO3S.C17H18O3S/c22-17-12-16(13-20-18(23)14-21(24)26-20)9-10-19(17)25-11-5-4-8-15-6-2-1-3-7-15;21-20-15(12-18-16(22)13-19(23)25-18)9-4-10-17(20)24-11-5-8-14-6-2-1-3-7-14;1-13-3-5-15(6-4-13)12-23-18-8-7-16(9-14(18)2)10-19-17(21)11-20(22)24-19;20-19-14(11-17-15(21)12-18(22)24-17)7-4-8-16(19)23-10-9-13-5-2-1-3-6-13;21-16-12-19(22)26-18(16)11-14-6-7-17(15(10-14)20(23)24)25-9-8-13-4-2-1-3-5-13;1-13-9-15(10-18-16(20)11-19(21)23-18)7-8-17(13)22-12-14-5-3-2-4-6-14;19-18-13(9-16-14(20)10-17(21)23-16)7-4-8-15(18)22-11-12-5-2-1-3-6-12;19-14-8-13(9-17-15(20)10-18(21)23-17)6-7-16(14)22-11-12-4-2-1-3-5-12;18-15-10-17(19)21-16(15)9-12-5-7-14(8-6-12)20-11-13-3-1-2-4-13/h9-10,12-13,15H,1-8,11,14H2;4,9-10,12,14H,1-3,5-8,11,13H2;7-10,13,15H,3-6,11-12H2,1-2H3;4,7-8,11,13H,1-3,5-6,9-10,12H2;6-7,10-11,13H,1-5,8-9,12H2;7-10,14H,2-6,11-12H2,1H3;4,7-9,12H,1-3,5-6,10-11H2;1-9H,10-11H2;5-9,13H,1-4,10-11H2/b20-13-;18-12-;19-10-;17-11-;18-11-;18-10-;16-9-;17-9-;16-9-.
What are the key properties of (5Z)-5-[[3-chloro-4-(4-cyclohexylbutoxy)phenyl]methylidene]thiolane-2,4-dione;(5Z)-5-[[2-chloro-3-(2-cyclohexylethoxy)phenyl]methylidene]thiolane-2,4-dione;(5Z)-5-[[2-chloro-3-(cyclohexylmethoxy)phenyl]methylidene]thiolane-2,4-dione;(5Z)-5-[[2-chloro-3-(3-cyclohexylpropoxy)phenyl]methylidene]thiolane-2,4-dione;(5Z)-5-[(3-chloro-4-phenylmethoxyphenyl)methylidene]thiolane-2,4-dione;(5Z)-5-[[4-(2-cyclohexylethoxy)-3-nitrophenyl]methylidene]thiolane-2,4-dione;(5Z)-5-[[4-(cyclohexylmethoxy)-3-methylphenyl]methylidene]thiolane-2,4-dione;(5Z)-5-[[4-(cyclopentylmethoxy)phenyl]methylidene]thiolane-2,4-dione;(5Z)-5-[[3-methyl-4-[(4-methylcyclohexyl)methoxy]phenyl]methylidene]thiolane-2,4-dione?
(5Z)-5-[[3-chloro-4-(4-cyclohexylbutoxy)phenyl]methylidene]thiolane-2,4-dione;(5Z)-5-[[2-chloro-3-(2-cyclohexylethoxy)phenyl]methylidene]thiolane-2,4-dione;(5Z)-5-[[2-chloro-3-(cyclohexylmethoxy)phenyl]methylidene]thiolane-2,4-dione;(5Z)-5-[[2-chloro-3-(3-cyclohexylpropoxy)phenyl]methylidene]thiolane-2,4-dione;(5Z)-5-[(3-chloro-4-phenylmethoxyphenyl)methylidene]thiolane-2,4-dione;(5Z)-5-[[4-(2-cyclohexylethoxy)-3-nitrophenyl]methylidene]thiolane-2,4-dione;(5Z)-5-[[4-(cyclohexylmethoxy)-3-methylphenyl]methylidene]thiolane-2,4-dione;(5Z)-5-[[4-(cyclopentylmethoxy)phenyl]methylidene]thiolane-2,4-dione;(5Z)-5-[[3-methyl-4-[(4-methylcyclohexyl)methoxy]phenyl]methylidene]thiolane-2,4-dione has a molecular weight of 3185.21 g/mol, XLogP of 43.97, 44 rotatable bonds, 0 hydrogen bond donors, and 38 hydrogen bond acceptors.
Where does this data come from?
All data for (5Z)-5-[[3-chloro-4-(4-cyclohexylbutoxy)phenyl]methylidene]thiolane-2,4-dione;(5Z)-5-[[2-chloro-3-(2-cyclohexylethoxy)phenyl]methylidene]thiolane-2,4-dione;(5Z)-5-[[2-chloro-3-(cyclohexylmethoxy)phenyl]methylidene]thiolane-2,4-dione;(5Z)-5-[[2-chloro-3-(3-cyclohexylpropoxy)phenyl]methylidene]thiolane-2,4-dione;(5Z)-5-[(3-chloro-4-phenylmethoxyphenyl)methylidene]thiolane-2,4-dione;(5Z)-5-[[4-(2-cyclohexylethoxy)-3-nitrophenyl]methylidene]thiolane-2,4-dione;(5Z)-5-[[4-(cyclohexylmethoxy)-3-methylphenyl]methylidene]thiolane-2,4-dione;(5Z)-5-[[4-(cyclopentylmethoxy)phenyl]methylidene]thiolane-2,4-dione;(5Z)-5-[[3-methyl-4-[(4-methylcyclohexyl)methoxy]phenyl]methylidene]thiolane-2,4-dione is sourced from PubChem (CID 162232959), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).