6-chloro-N-[2-(4-chlorophenyl)ethyl]-7-hydroxy-8-methoxy-1,3,4,5-tetrahydro-2-benzazepine-2-carbothioamide;8-chloro-N-[2-(4-chlorophenyl)ethyl]-7-hydroxy-1,3,4,5-tetrahydro-2-benzazepine-2-carbothioamide;N-[2-(2-chlorophenyl)ethyl]-7,8-dihydroxy-1,3,4,5-tetrahydro-2-benzazepine-2-carbothioamide;N-[2-(4-chlorophenyl)ethyl]-7-hydroxy-1,2,4,5-tetrahydro-3-benzazepine-3-carbothioamide;N-[2-(3,4-dichlorophenyl)ethyl]-7,8-dihydroxy-1,3,4,5-tetrahydro-2-benzazepine-2-carbothioamide;7,8-dihydroxy-N-[2-(4-methoxyphenyl)ethyl]-1,3,4,5-tetrahydro-2-benzazepine-2-carbothioamide;7,8-dihydroxy-N-[[4-(trifluoromethyl)phenyl]methyl]-1,3,4,5-tetrahydro-2-benzazepine-2-carbothioamide

C135H147Cl8F3N14O13S7 — CID 158567885

IUPAC6-chloro-N-[2-(4-chlorophenyl)ethyl]-7-hydroxy-8-methoxy-1,3,4,5-tetrahydro-2-benzazepine-2-carbothioamide;8-chloro-N-[2-(4-chlorophenyl)ethyl]-7-hydroxy-1,3,4,5-tetrahydro-2-benzazepine-2-carbothioamide;N-[2-(2-chlorophenyl)ethyl]-7,8-dihydroxy-1,3,4,5-tetrahydro-2-benzazepine-2-carbothioamide;N-[2-(4-chlorophenyl)ethyl]-7-hydroxy-1,2,4,5-tetrahydro-3-benzazepine-3-carbothioamide;N-[2-(3,4-dichlorophenyl)ethyl]-7,8-dihydroxy-1,3,4,5-tetrahydro-2-benzazepine-2-carbothioamide;7,8-dihydroxy-N-[2-(4-methoxyphenyl)ethyl]-1,3,4,5-tetrahydro-2-benzazepine-2-carbothioamide;7,8-dihydroxy-N-[[4-(trifluoromethyl)phenyl]methyl]-1,3,4,5-tetrahydro-2-benzazepine-2-carbothioamide
SMILESCOc1cc2c(c(Cl)c1O)CCCN(C(=S)NCCc1ccc(Cl)cc1)C2.COc1ccc(CCNC(=S)N2CCCc3cc(O)c(O)cc3C2)cc1.Oc1cc2c(cc1Cl)CN(C(=S)NCCc1ccc(Cl)cc1)CCC2.Oc1cc2c(cc1O)CN(C(=S)NCCc1ccc(Cl)c(Cl)c1)CCC2.Oc1cc2c(cc1O)CN(C(=S)NCCc1ccccc1Cl)CCC2.Oc1cc2c(cc1O)CN(C(=S)NCc1ccc(C(F)(F)F)cc1)CCC2.Oc1ccc2c(c1)CCN(C(=S)NCCc1ccc(Cl)cc1)CC2
InChIInChI=1S/C20H22Cl2N2O2S.C20H24N2O3S.C19H20Cl2N2O2S.C19H20Cl2N2OS.C19H21ClN2O2S.C19H21ClN2OS.C19H19F3N2O2S/c1-26-17-11-14-12-24(10-2-3-16(14)18(22)19(17)25)20(27)23-9-8-13-4-6-15(21)7-5-13;1-25-17-6-4-14(5-7-17)8-9-21-20(26)22-10-2-3-15-11-18(23)19(24)12-16(15)13-22;20-15-4-3-12(8-16(15)21)5-6-22-19(26)23-7-1-2-13-9-17(24)18(25)10-14(13)11-23;20-16-5-3-13(4-6-16)7-8-22-19(25)23-9-1-2-14-11-18(24)17(21)10-15(14)12-23;20-16-6-2-1-4-13(16)7-8-21-19(25)22-9-3-5-14-10-17(23)18(24)11-15(14)12-22;20-17-4-1-14(2-5-17)7-10-21-19(24)22-11-8-15-3-6-18(23)13-16(15)9-12-22;20-19(21,22)15-5-3-12(4-6-15)10-23-18(27)24-7-1-2-13-8-16(25)17(26)9-14(13)11-24/h4-7,11,25H,2-3,8-10,12H2,1H3,(H,23,27);4-7,11-12,23-24H,2-3,8-10,13H2,1H3,(H,21,26);3-4,8-10,24-25H,1-2,5-7,11H2,(H,22,26);3-6,10-11,24H,1-2,7-9,12H2,(H,22,25);1-2,4,6,10-11,23-24H,3,5,7-9,12H2,(H,21,25);1-6,13,23H,7-12H2,(H,21,24);3-6,8-9,25-26H,1-2,7,10-11H2,(H,23,27)
InChIKeyHRSBBEWPCBHKFJ-UHFFFAOYSA-N
MW2738.83 g/mol
LogP27.50
Rot. Bonds22

About 6-chloro-N-[2-(4-chlorophenyl)ethyl]-7-hydroxy-8-methoxy-1,3,4,5-tetrahydro-2-benzazepine-2-carbothioamide;8-chloro-N-[2-(4-chlorophenyl)ethyl]-7-hydroxy-1,3,4,5-tetrahydro-2-benzazepine-2-carbothioamide;N-[2-(2-chlorophenyl)ethyl]-7,8-dihydroxy-1,3,4,5-tetrahydro-2-benzazepine-2-carbothioamide;N-[2-(4-chlorophenyl)ethyl]-7-hydroxy-1,2,4,5-tetrahydro-3-benzazepine-3-carbothioamide;N-[2-(3,4-dichlorophenyl)ethyl]-7,8-dihydroxy-1,3,4,5-tetrahydro-2-benzazepine-2-carbothioamide;7,8-dihydroxy-N-[2-(4-methoxyphenyl)ethyl]-1,3,4,5-tetrahydro-2-benzazepine-2-carbothioamide;7,8-dihydroxy-N-[[4-(trifluoromethyl)phenyl]methyl]-1,3,4,5-tetrahydro-2-benzazepine-2-carbothioamide

6-chloro-N-[2-(4-chlorophenyl)ethyl]-7-hydroxy-8-methoxy-1,3,4,5-tetrahydro-2-benzazepine-2-carbothioamide;8-chloro-N-[2-(4-chlorophenyl)ethyl]-7-hydroxy-1,3,4,5-tetrahydro-2-benzazepine-2-carbothioamide;N-[2-(2-chlorophenyl)ethyl]-7,8-dihydroxy-1,3,4,5-tetrahydro-2-benzazepine-2-carbothioamide;N-[2-(4-chlorophenyl)ethyl]-7-hydroxy-1,2,4,5-tetrahydro-3-benzazepine-3-carbothioamide;N-[2-(3,4-dichlorophenyl)ethyl]-7,8-dihydroxy-1,3,4,5-tetrahydro-2-benzazepine-2-carbothioamide;7,8-dihydroxy-N-[2-(4-methoxyphenyl)ethyl]-1,3,4,5-tetrahydro-2-benzazepine-2-carbothioamide;7,8-dihydroxy-N-[[4-(trifluoromethyl)phenyl]methyl]-1,3,4,5-tetrahydro-2-benzazepine-2-carbothioamide (PubChem CID 158567885) has the molecular formula C135H147Cl8F3N14O13S7 and a molecular weight of 2738.83 g/mol. Its IUPAC name is 6-chloro-N-[2-(4-chlorophenyl)ethyl]-7-hydroxy-8-methoxy-1,3,4,5-tetrahydro-2-benzazepine-2-carbothioamide;8-chloro-N-[2-(4-chlorophenyl)ethyl]-7-hydroxy-1,3,4,5-tetrahydro-2-benzazepine-2-carbothioamide;N-[2-(2-chlorophenyl)ethyl]-7,8-dihydroxy-1,3,4,5-tetrahydro-2-benzazepine-2-carbothioamide;N-[2-(4-chlorophenyl)ethyl]-7-hydroxy-1,2,4,5-tetrahydro-3-benzazepine-3-carbothioamide;N-[2-(3,4-dichlorophenyl)ethyl]-7,8-dihydroxy-1,3,4,5-tetrahydro-2-benzazepine-2-carbothioamide;7,8-dihydroxy-N-[2-(4-methoxyphenyl)ethyl]-1,3,4,5-tetrahydro-2-benzazepine-2-carbothioamide;7,8-dihydroxy-N-[[4-(trifluoromethyl)phenyl]methyl]-1,3,4,5-tetrahydro-2-benzazepine-2-carbothioamide.

Molecular Properties

Compound Name6-chloro-N-[2-(4-chlorophenyl)ethyl]-7-hydroxy-8-methoxy-1,3,4,5-tetrahydro-2-benzazepine-2-carbothioamide;8-chloro-N-[2-(4-chlorophenyl)ethyl]-7-hydroxy-1,3,4,5-tetrahydro-2-benzazepine-2-carbothioamide;N-[2-(2-chlorophenyl)ethyl]-7,8-dihydroxy-1,3,4,5-tetrahydro-2-benzazepine-2-carbothioamide;N-[2-(4-chlorophenyl)ethyl]-7-hydroxy-1,2,4,5-tetrahydro-3-benzazepine-3-carbothioamide;N-[2-(3,4-dichlorophenyl)ethyl]-7,8-dihydroxy-1,3,4,5-tetrahydro-2-benzazepine-2-carbothioamide;7,8-dihydroxy-N-[2-(4-methoxyphenyl)ethyl]-1,3,4,5-tetrahydro-2-benzazepine-2-carbothioamide;7,8-dihydroxy-N-[[4-(trifluoromethyl)phenyl]methyl]-1,3,4,5-tetrahydro-2-benzazepine-2-carbothioamide
PubChem CID158567885
Molecular FormulaC135H147Cl8F3N14O13S7
Molecular Weight2738.83 g/mol
Exact Mass2732.68
IUPAC Name6-chloro-N-[2-(4-chlorophenyl)ethyl]-7-hydroxy-8-methoxy-1,3,4,5-tetrahydro-2-benzazepine-2-carbothioamide;8-chloro-N-[2-(4-chlorophenyl)ethyl]-7-hydroxy-1,3,4,5-tetrahydro-2-benzazepine-2-carbothioamide;N-[2-(2-chlorophenyl)ethyl]-7,8-dihydroxy-1,3,4,5-tetrahydro-2-benzazepine-2-carbothioamide;N-[2-(4-chlorophenyl)ethyl]-7-hydroxy-1,2,4,5-tetrahydro-3-benzazepine-3-carbothioamide;N-[2-(3,4-dichlorophenyl)ethyl]-7,8-dihydroxy-1,3,4,5-tetrahydro-2-benzazepine-2-carbothioamide;7,8-dihydroxy-N-[2-(4-methoxyphenyl)ethyl]-1,3,4,5-tetrahydro-2-benzazepine-2-carbothioamide;7,8-dihydroxy-N-[[4-(trifluoromethyl)phenyl]methyl]-1,3,4,5-tetrahydro-2-benzazepine-2-carbothioamide
SMILESCOc1cc2c(c(Cl)c1O)CCCN(C(=S)NCCc1ccc(Cl)cc1)C2.COc1ccc(CCNC(=S)N2CCCc3cc(O)c(O)cc3C2)cc1.Oc1cc2c(cc1Cl)CN(C(=S)NCCc1ccc(Cl)cc1)CCC2.Oc1cc2c(cc1O)CN(C(=S)NCCc1ccc(Cl)c(Cl)c1)CCC2.Oc1cc2c(cc1O)CN(C(=S)NCCc1ccccc1Cl)CCC2.Oc1cc2c(cc1O)CN(C(=S)NCc1ccc(C(F)(F)F)cc1)CCC2.Oc1ccc2c(c1)CCN(C(=S)NCCc1ccc(Cl)cc1)CC2
InChIInChI=1S/C20H22Cl2N2O2S.C20H24N2O3S.C19H20Cl2N2O2S.C19H20Cl2N2OS.C19H21ClN2O2S.C19H21ClN2OS.C19H19F3N2O2S/c1-26-17-11-14-12-24(10-2-3-16(14)18(22)19(17)25)20(27)23-9-8-13-4-6-15(21)7-5-13;1-25-17-6-4-14(5-7-17)8-9-21-20(26)22-10-2-3-15-11-18(23)19(24)12-16(15)13-22;20-15-4-3-12(8-16(15)21)5-6-22-19(26)23-7-1-2-13-9-17(24)18(25)10-14(13)11-23;20-16-5-3-13(4-6-16)7-8-22-19(25)23-9-1-2-14-11-18(24)17(21)10-15(14)12-23;20-16-6-2-1-4-13(16)7-8-21-19(25)22-9-3-5-14-10-17(23)18(24)11-15(14)12-22;20-17-4-1-14(2-5-17)7-10-21-19(24)22-11-8-15-3-6-18(23)13-16(15)9-12-22;20-19(21,22)15-5-3-12(4-6-15)10-23-18(27)24-7-1-2-13-8-16(25)17(26)9-14(13)11-24/h4-7,11,25H,2-3,8-10,12H2,1H3,(H,23,27);4-7,11-12,23-24H,2-3,8-10,13H2,1H3,(H,21,26);3-4,8-10,24-25H,1-2,5-7,11H2,(H,22,26);3-6,10-11,24H,1-2,7-9,12H2,(H,22,25);1-2,4,6,10-11,23-24H,3,5,7-9,12H2,(H,21,25);1-6,13,23H,7-12H2,(H,21,24);3-6,8-9,25-26H,1-2,7,10-11H2,(H,23,27)
InChIKeyHRSBBEWPCBHKFJ-UHFFFAOYSA-N
XLogP27.50
TPSA347.88 Ų
H-Bond Donors18
H-Bond Acceptors20
Rotatable Bonds22
Heavy Atoms180
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5002738.83
LogP ≤ 527.50
H-Bond Donors ≤ 518
H-Bond Acceptors ≤ 1020

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'catechol_A(92)', 'substructure': 'N/A'}, {'alert_name': 'catechol', 'substructure': 'N/A'}, {'alert_name': 'Thiocarbonyl_group', 'substructure': 'N/A'}

Analyze 6-chloro-N-[2-(4-chlorophenyl)ethyl]-7-hydroxy-8-methoxy-1,3,4,5-tetrahydro-2-benzazepine-2-carbothioamide;8-chloro-N-[2-(4-chlorophenyl)ethyl]-7-hydroxy-1,3,4,5-tetrahydro-2-benzazepine-2-carbothioamide;N-[2-(2-chlorophenyl)ethyl]-7,8-dihydroxy-1,3,4,5-tetrahydro-2-benzazepine-2-carbothioamide;N-[2-(4-chlorophenyl)ethyl]-7-hydroxy-1,2,4,5-tetrahydro-3-benzazepine-3-carbothioamide;N-[2-(3,4-dichlorophenyl)ethyl]-7,8-dihydroxy-1,3,4,5-tetrahydro-2-benzazepine-2-carbothioamide;7,8-dihydroxy-N-[2-(4-methoxyphenyl)ethyl]-1,3,4,5-tetrahydro-2-benzazepine-2-carbothioamide;7,8-dihydroxy-N-[[4-(trifluoromethyl)phenyl]methyl]-1,3,4,5-tetrahydro-2-benzazepine-2-carbothioamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 6-chloro-N-[2-(4-chlorophenyl)ethyl]-7-hydroxy-8-methoxy-1,3,4,5-tetrahydro-2-benzazepine-2-carbothioamide;8-chloro-N-[2-(4-chlorophenyl)ethyl]-7-hydroxy-1,3,4,5-tetrahydro-2-benzazepine-2-carbothioamide;N-[2-(2-chlorophenyl)ethyl]-7,8-dihydroxy-1,3,4,5-tetrahydro-2-benzazepine-2-carbothioamide;N-[2-(4-chlorophenyl)ethyl]-7-hydroxy-1,2,4,5-tetrahydro-3-benzazepine-3-carbothioamide;N-[2-(3,4-dichlorophenyl)ethyl]-7,8-dihydroxy-1,3,4,5-tetrahydro-2-benzazepine-2-carbothioamide;7,8-dihydroxy-N-[2-(4-methoxyphenyl)ethyl]-1,3,4,5-tetrahydro-2-benzazepine-2-carbothioamide;7,8-dihydroxy-N-[[4-(trifluoromethyl)phenyl]methyl]-1,3,4,5-tetrahydro-2-benzazepine-2-carbothioamide?
The IUPAC name of 6-chloro-N-[2-(4-chlorophenyl)ethyl]-7-hydroxy-8-methoxy-1,3,4,5-tetrahydro-2-benzazepine-2-carbothioamide;8-chloro-N-[2-(4-chlorophenyl)ethyl]-7-hydroxy-1,3,4,5-tetrahydro-2-benzazepine-2-carbothioamide;N-[2-(2-chlorophenyl)ethyl]-7,8-dihydroxy-1,3,4,5-tetrahydro-2-benzazepine-2-carbothioamide;N-[2-(4-chlorophenyl)ethyl]-7-hydroxy-1,2,4,5-tetrahydro-3-benzazepine-3-carbothioamide;N-[2-(3,4-dichlorophenyl)ethyl]-7,8-dihydroxy-1,3,4,5-tetrahydro-2-benzazepine-2-carbothioamide;7,8-dihydroxy-N-[2-(4-methoxyphenyl)ethyl]-1,3,4,5-tetrahydro-2-benzazepine-2-carbothioamide;7,8-dihydroxy-N-[[4-(trifluoromethyl)phenyl]methyl]-1,3,4,5-tetrahydro-2-benzazepine-2-carbothioamide (CID 158567885) is 6-chloro-N-[2-(4-chlorophenyl)ethyl]-7-hydroxy-8-methoxy-1,3,4,5-tetrahydro-2-benzazepine-2-carbothioamide;8-chloro-N-[2-(4-chlorophenyl)ethyl]-7-hydroxy-1,3,4,5-tetrahydro-2-benzazepine-2-carbothioamide;N-[2-(2-chlorophenyl)ethyl]-7,8-dihydroxy-1,3,4,5-tetrahydro-2-benzazepine-2-carbothioamide;N-[2-(4-chlorophenyl)ethyl]-7-hydroxy-1,2,4,5-tetrahydro-3-benzazepine-3-carbothioamide;N-[2-(3,4-dichlorophenyl)ethyl]-7,8-dihydroxy-1,3,4,5-tetrahydro-2-benzazepine-2-carbothioamide;7,8-dihydroxy-N-[2-(4-methoxyphenyl)ethyl]-1,3,4,5-tetrahydro-2-benzazepine-2-carbothioamide;7,8-dihydroxy-N-[[4-(trifluoromethyl)phenyl]methyl]-1,3,4,5-tetrahydro-2-benzazepine-2-carbothioamide.
What is the SMILES notation for 6-chloro-N-[2-(4-chlorophenyl)ethyl]-7-hydroxy-8-methoxy-1,3,4,5-tetrahydro-2-benzazepine-2-carbothioamide;8-chloro-N-[2-(4-chlorophenyl)ethyl]-7-hydroxy-1,3,4,5-tetrahydro-2-benzazepine-2-carbothioamide;N-[2-(2-chlorophenyl)ethyl]-7,8-dihydroxy-1,3,4,5-tetrahydro-2-benzazepine-2-carbothioamide;N-[2-(4-chlorophenyl)ethyl]-7-hydroxy-1,2,4,5-tetrahydro-3-benzazepine-3-carbothioamide;N-[2-(3,4-dichlorophenyl)ethyl]-7,8-dihydroxy-1,3,4,5-tetrahydro-2-benzazepine-2-carbothioamide;7,8-dihydroxy-N-[2-(4-methoxyphenyl)ethyl]-1,3,4,5-tetrahydro-2-benzazepine-2-carbothioamide;7,8-dihydroxy-N-[[4-(trifluoromethyl)phenyl]methyl]-1,3,4,5-tetrahydro-2-benzazepine-2-carbothioamide?
The canonical SMILES for 6-chloro-N-[2-(4-chlorophenyl)ethyl]-7-hydroxy-8-methoxy-1,3,4,5-tetrahydro-2-benzazepine-2-carbothioamide;8-chloro-N-[2-(4-chlorophenyl)ethyl]-7-hydroxy-1,3,4,5-tetrahydro-2-benzazepine-2-carbothioamide;N-[2-(2-chlorophenyl)ethyl]-7,8-dihydroxy-1,3,4,5-tetrahydro-2-benzazepine-2-carbothioamide;N-[2-(4-chlorophenyl)ethyl]-7-hydroxy-1,2,4,5-tetrahydro-3-benzazepine-3-carbothioamide;N-[2-(3,4-dichlorophenyl)ethyl]-7,8-dihydroxy-1,3,4,5-tetrahydro-2-benzazepine-2-carbothioamide;7,8-dihydroxy-N-[2-(4-methoxyphenyl)ethyl]-1,3,4,5-tetrahydro-2-benzazepine-2-carbothioamide;7,8-dihydroxy-N-[[4-(trifluoromethyl)phenyl]methyl]-1,3,4,5-tetrahydro-2-benzazepine-2-carbothioamide is COc1cc2c(c(Cl)c1O)CCCN(C(=S)NCCc1ccc(Cl)cc1)C2.COc1ccc(CCNC(=S)N2CCCc3cc(O)c(O)cc3C2)cc1.Oc1cc2c(cc1Cl)CN(C(=S)NCCc1ccc(Cl)cc1)CCC2.Oc1cc2c(cc1O)CN(C(=S)NCCc1ccc(Cl)c(Cl)c1)CCC2.Oc1cc2c(cc1O)CN(C(=S)NCCc1ccccc1Cl)CCC2.Oc1cc2c(cc1O)CN(C(=S)NCc1ccc(C(F)(F)F)cc1)CCC2.Oc1ccc2c(c1)CCN(C(=S)NCCc1ccc(Cl)cc1)CC2.
What is the InChIKey of 6-chloro-N-[2-(4-chlorophenyl)ethyl]-7-hydroxy-8-methoxy-1,3,4,5-tetrahydro-2-benzazepine-2-carbothioamide;8-chloro-N-[2-(4-chlorophenyl)ethyl]-7-hydroxy-1,3,4,5-tetrahydro-2-benzazepine-2-carbothioamide;N-[2-(2-chlorophenyl)ethyl]-7,8-dihydroxy-1,3,4,5-tetrahydro-2-benzazepine-2-carbothioamide;N-[2-(4-chlorophenyl)ethyl]-7-hydroxy-1,2,4,5-tetrahydro-3-benzazepine-3-carbothioamide;N-[2-(3,4-dichlorophenyl)ethyl]-7,8-dihydroxy-1,3,4,5-tetrahydro-2-benzazepine-2-carbothioamide;7,8-dihydroxy-N-[2-(4-methoxyphenyl)ethyl]-1,3,4,5-tetrahydro-2-benzazepine-2-carbothioamide;7,8-dihydroxy-N-[[4-(trifluoromethyl)phenyl]methyl]-1,3,4,5-tetrahydro-2-benzazepine-2-carbothioamide?
The InChIKey is HRSBBEWPCBHKFJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H22Cl2N2O2S.C20H24N2O3S.C19H20Cl2N2O2S.C19H20Cl2N2OS.C19H21ClN2O2S.C19H21ClN2OS.C19H19F3N2O2S/c1-26-17-11-14-12-24(10-2-3-16(14)18(22)19(17)25)20(27)23-9-8-13-4-6-15(21)7-5-13;1-25-17-6-4-14(5-7-17)8-9-21-20(26)22-10-2-3-15-11-18(23)19(24)12-16(15)13-22;20-15-4-3-12(8-16(15)21)5-6-22-19(26)23-7-1-2-13-9-17(24)18(25)10-14(13)11-23;20-16-5-3-13(4-6-16)7-8-22-19(25)23-9-1-2-14-11-18(24)17(21)10-15(14)12-23;20-16-6-2-1-4-13(16)7-8-21-19(25)22-9-3-5-14-10-17(23)18(24)11-15(14)12-22;20-17-4-1-14(2-5-17)7-10-21-19(24)22-11-8-15-3-6-18(23)13-16(15)9-12-22;20-19(21,22)15-5-3-12(4-6-15)10-23-18(27)24-7-1-2-13-8-16(25)17(26)9-14(13)11-24/h4-7,11,25H,2-3,8-10,12H2,1H3,(H,23,27);4-7,11-12,23-24H,2-3,8-10,13H2,1H3,(H,21,26);3-4,8-10,24-25H,1-2,5-7,11H2,(H,22,26);3-6,10-11,24H,1-2,7-9,12H2,(H,22,25);1-2,4,6,10-11,23-24H,3,5,7-9,12H2,(H,21,25);1-6,13,23H,7-12H2,(H,21,24);3-6,8-9,25-26H,1-2,7,10-11H2,(H,23,27).
What are the key properties of 6-chloro-N-[2-(4-chlorophenyl)ethyl]-7-hydroxy-8-methoxy-1,3,4,5-tetrahydro-2-benzazepine-2-carbothioamide;8-chloro-N-[2-(4-chlorophenyl)ethyl]-7-hydroxy-1,3,4,5-tetrahydro-2-benzazepine-2-carbothioamide;N-[2-(2-chlorophenyl)ethyl]-7,8-dihydroxy-1,3,4,5-tetrahydro-2-benzazepine-2-carbothioamide;N-[2-(4-chlorophenyl)ethyl]-7-hydroxy-1,2,4,5-tetrahydro-3-benzazepine-3-carbothioamide;N-[2-(3,4-dichlorophenyl)ethyl]-7,8-dihydroxy-1,3,4,5-tetrahydro-2-benzazepine-2-carbothioamide;7,8-dihydroxy-N-[2-(4-methoxyphenyl)ethyl]-1,3,4,5-tetrahydro-2-benzazepine-2-carbothioamide;7,8-dihydroxy-N-[[4-(trifluoromethyl)phenyl]methyl]-1,3,4,5-tetrahydro-2-benzazepine-2-carbothioamide?
6-chloro-N-[2-(4-chlorophenyl)ethyl]-7-hydroxy-8-methoxy-1,3,4,5-tetrahydro-2-benzazepine-2-carbothioamide;8-chloro-N-[2-(4-chlorophenyl)ethyl]-7-hydroxy-1,3,4,5-tetrahydro-2-benzazepine-2-carbothioamide;N-[2-(2-chlorophenyl)ethyl]-7,8-dihydroxy-1,3,4,5-tetrahydro-2-benzazepine-2-carbothioamide;N-[2-(4-chlorophenyl)ethyl]-7-hydroxy-1,2,4,5-tetrahydro-3-benzazepine-3-carbothioamide;N-[2-(3,4-dichlorophenyl)ethyl]-7,8-dihydroxy-1,3,4,5-tetrahydro-2-benzazepine-2-carbothioamide;7,8-dihydroxy-N-[2-(4-methoxyphenyl)ethyl]-1,3,4,5-tetrahydro-2-benzazepine-2-carbothioamide;7,8-dihydroxy-N-[[4-(trifluoromethyl)phenyl]methyl]-1,3,4,5-tetrahydro-2-benzazepine-2-carbothioamide has a molecular weight of 2738.83 g/mol, XLogP of 27.50, 22 rotatable bonds, 18 hydrogen bond donors, and 20 hydrogen bond acceptors.
Where does this data come from?
All data for 6-chloro-N-[2-(4-chlorophenyl)ethyl]-7-hydroxy-8-methoxy-1,3,4,5-tetrahydro-2-benzazepine-2-carbothioamide;8-chloro-N-[2-(4-chlorophenyl)ethyl]-7-hydroxy-1,3,4,5-tetrahydro-2-benzazepine-2-carbothioamide;N-[2-(2-chlorophenyl)ethyl]-7,8-dihydroxy-1,3,4,5-tetrahydro-2-benzazepine-2-carbothioamide;N-[2-(4-chlorophenyl)ethyl]-7-hydroxy-1,2,4,5-tetrahydro-3-benzazepine-3-carbothioamide;N-[2-(3,4-dichlorophenyl)ethyl]-7,8-dihydroxy-1,3,4,5-tetrahydro-2-benzazepine-2-carbothioamide;7,8-dihydroxy-N-[2-(4-methoxyphenyl)ethyl]-1,3,4,5-tetrahydro-2-benzazepine-2-carbothioamide;7,8-dihydroxy-N-[[4-(trifluoromethyl)phenyl]methyl]-1,3,4,5-tetrahydro-2-benzazepine-2-carbothioamide is sourced from PubChem (CID 158567885), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).