tert-butyl N-[5-isoquinolin-6-yl-4-(1,3-oxazol-5-yl)-1,3-thiazol-2-yl]-N-[(2S)-2-methyl-3-(4-methylphenyl)propyl]carbamate;5-chloro-N-[5-(4-cyclohexylpiperazin-1-yl)-4-(2-methyl-1H-imidazol-5-yl)-1,3-thiazol-2-yl]-6-(hydroxymethoxy)pyridine-3-carboxamide;5-chloro-N-[5-(4-cyclohexylpiperazin-1-yl)-4-(2-methyl-1,3-oxazol-5-yl)-1,3-thiazol-2-yl]-6-(hydroxymethoxy)pyridine-3-carboxamide;5-chloro-N-[5-(4-cyclohexylpiperazin-1-yl)-4-(2-methyl-1,3-thiazol-5-yl)-1,3-thiazol-2-yl]-6-(hydroxymethoxy)pyridine-3-carboxamide;2-[4-[2-[2-[[1-[(3,4-dichlorophenyl)methyl]piperidin-4-yl]amino]-2-oxoethyl]sulfanyl-4-methyl-1,3-thiazol-5-yl]-1,3-thiazol-2-yl]acetamide;2-[4-(2,4-dimethyl-1,3-thiazol-5-yl)-1,3-thiazol-2-yl]-1-(1-methyl-5-methylidenepyrrolidin-3-yl)ethanone;N-[4-(4-methyl-2-pyrazin-2-yl-1,3-thiazol-5-yl)-1,3-thiazol-2-yl]-N-(3-morpholin-4-ylpropyl)thiophene-2-carboxamide;sulfane

C165H190Cl5N37O18S14 — CID 159289652

About tert-butyl N-[5-isoquinolin-6-yl-4-(1,3-oxazol-5-yl)-1,3-thiazol-2-yl]-N-[(2S)-2-methyl-3-(4-methylphenyl)propyl]carbamate;5-chloro-N-[5-(4-cyclohexylpiperazin-1-yl)-4-(2-methyl-1H-imidazol-5-yl)-1,3-thiazol-2-yl]-6-(hydroxymethoxy)pyridine-3-carboxamide;5-chloro-N-[5-(4-cyclohexylpiperazin-1-yl)-4-(2-methyl-1,3-oxazol-5-yl)-1,3-thiazol-2-yl]-6-(hydroxymethoxy)pyridine-3-carboxamide;5-chloro-N-[5-(4-cyclohexylpiperazin-1-yl)-4-(2-methyl-1,3-thiazol-5-yl)-1,3-thiazol-2-yl]-6-(hydroxymethoxy)pyridine-3-carboxamide;2-[4-[2-[2-[[1-[(3,4-dichlorophenyl)methyl]piperidin-4-yl]amino]-2-oxoethyl]sulfanyl-4-methyl-1,3-thiazol-5-yl]-1,3-thiazol-2-yl]acetamide;2-[4-(2,4-dimethyl-1,3-thiazol-5-yl)-1,3-thiazol-2-yl]-1-(1-methyl-5-methylidenepyrrolidin-3-yl)ethanone;N-[4-(4-methyl-2-pyrazin-2-yl-1,3-thiazol-5-yl)-1,3-thiazol-2-yl]-N-(3-morpholin-4-ylpropyl)thiophene-2-carboxamide;sulfane

tert-butyl N-[5-isoquinolin-6-yl-4-(1,3-oxazol-5-yl)-1,3-thiazol-2-yl]-N-[(2S)-2-methyl-3-(4-methylphenyl)propyl]carbamate;5-chloro-N-[5-(4-cyclohexylpiperazin-1-yl)-4-(2-methyl-1H-imidazol-5-yl)-1,3-thiazol-2-yl]-6-(hydroxymethoxy)pyridine-3-carboxamide;5-chloro-N-[5-(4-cyclohexylpiperazin-1-yl)-4-(2-methyl-1,3-oxazol-5-yl)-1,3-thiazol-2-yl]-6-(hydroxymethoxy)pyridine-3-carboxamide;5-chloro-N-[5-(4-cyclohexylpiperazin-1-yl)-4-(2-methyl-1,3-thiazol-5-yl)-1,3-thiazol-2-yl]-6-(hydroxymethoxy)pyridine-3-carboxamide;2-[4-[2-[2-[[1-[(3,4-dichlorophenyl)methyl]piperidin-4-yl]amino]-2-oxoethyl]sulfanyl-4-methyl-1,3-thiazol-5-yl]-1,3-thiazol-2-yl]acetamide;2-[4-(2,4-dimethyl-1,3-thiazol-5-yl)-1,3-thiazol-2-yl]-1-(1-methyl-5-methylidenepyrrolidin-3-yl)ethanone;N-[4-(4-methyl-2-pyrazin-2-yl-1,3-thiazol-5-yl)-1,3-thiazol-2-yl]-N-(3-morpholin-4-ylpropyl)thiophene-2-carboxamide;sulfane (PubChem CID 159289652) has the molecular formula C165H190Cl5N37O18S14 and a molecular weight of 3605.78 g/mol. Its IUPAC name is tert-butyl N-[5-isoquinolin-6-yl-4-(1,3-oxazol-5-yl)-1,3-thiazol-2-yl]-N-[(2S)-2-methyl-3-(4-methylphenyl)propyl]carbamate;5-chloro-N-[5-(4-cyclohexylpiperazin-1-yl)-4-(2-methyl-1H-imidazol-5-yl)-1,3-thiazol-2-yl]-6-(hydroxymethoxy)pyridine-3-carboxamide;5-chloro-N-[5-(4-cyclohexylpiperazin-1-yl)-4-(2-methyl-1,3-oxazol-5-yl)-1,3-thiazol-2-yl]-6-(hydroxymethoxy)pyridine-3-carboxamide;5-chloro-N-[5-(4-cyclohexylpiperazin-1-yl)-4-(2-methyl-1,3-thiazol-5-yl)-1,3-thiazol-2-yl]-6-(hydroxymethoxy)pyridine-3-carboxamide;2-[4-[2-[2-[[1-[(3,4-dichlorophenyl)methyl]piperidin-4-yl]amino]-2-oxoethyl]sulfanyl-4-methyl-1,3-thiazol-5-yl]-1,3-thiazol-2-yl]acetamide;2-[4-(2,4-dimethyl-1,3-thiazol-5-yl)-1,3-thiazol-2-yl]-1-(1-methyl-5-methylidenepyrrolidin-3-yl)ethanone;N-[4-(4-methyl-2-pyrazin-2-yl-1,3-thiazol-5-yl)-1,3-thiazol-2-yl]-N-(3-morpholin-4-ylpropyl)thiophene-2-carboxamide;sulfane.

Molecular Properties

• Compound Name: tert-butyl N-[5-isoquinolin-6-yl-4-(1,3-oxazol-5-yl)-1,3-thiazol-2-yl]-N-[(2S)-2-methyl-3-(4-methylphenyl)propyl]carbamate;5-chloro-N-[5-(4-cyclohexylpiperazin-1-yl)-4-(2-methyl-1H-imidazol-5-yl)-1,3-thiazol-2-yl]-6-(hydroxymethoxy)pyridine-3-carboxamide;5-chloro-N-[5-(4-cyclohexylpiperazin-1-yl)-4-(2-methyl-1,3-oxazol-5-yl)-1,3-thiazol-2-yl]-6-(hydroxymethoxy)pyridine-3-carboxamide;5-chloro-N-[5-(4-cyclohexylpiperazin-1-yl)-4-(2-methyl-1,3-thiazol-5-yl)-1,3-thiazol-2-yl]-6-(hydroxymethoxy)pyridine-3-carboxamide;2-[4-[2-[2-[[1-[(3,4-dichlorophenyl)methyl]piperidin-4-yl]amino]-2-oxoethyl]sulfanyl-4-methyl-1,3-thiazol-5-yl]-1,3-thiazol-2-yl]acetamide;2-[4-(2,4-dimethyl-1,3-thiazol-5-yl)-1,3-thiazol-2-yl]-1-(1-methyl-5-methylidenepyrrolidin-3-yl)ethanone;N-[4-(4-methyl-2-pyrazin-2-yl-1,3-thiazol-5-yl)-1,3-thiazol-2-yl]-N-(3-morpholin-4-ylpropyl)thiophene-2-carboxamide;sulfane
• PubChem CID: 159289652
• Molecular Formula: C165H190Cl5N37O18S14
• Molecular Weight: 3605.78 g/mol
• Exact Mass: 3599.96
• IUPAC Name: tert-butyl N-[5-isoquinolin-6-yl-4-(1,3-oxazol-5-yl)-1,3-thiazol-2-yl]-N-[(2S)-2-methyl-3-(4-methylphenyl)propyl]carbamate;5-chloro-N-[5-(4-cyclohexylpiperazin-1-yl)-4-(2-methyl-1H-imidazol-5-yl)-1,3-thiazol-2-yl]-6-(hydroxymethoxy)pyridine-3-carboxamide;5-chloro-N-[5-(4-cyclohexylpiperazin-1-yl)-4-(2-methyl-1,3-oxazol-5-yl)-1,3-thiazol-2-yl]-6-(hydroxymethoxy)pyridine-3-carboxamide;5-chloro-N-[5-(4-cyclohexylpiperazin-1-yl)-4-(2-methyl-1,3-thiazol-5-yl)-1,3-thiazol-2-yl]-6-(hydroxymethoxy)pyridine-3-carboxamide;2-[4-[2-[2-[[1-[(3,4-dichlorophenyl)methyl]piperidin-4-yl]amino]-2-oxoethyl]sulfanyl-4-methyl-1,3-thiazol-5-yl]-1,3-thiazol-2-yl]acetamide;2-[4-(2,4-dimethyl-1,3-thiazol-5-yl)-1,3-thiazol-2-yl]-1-(1-methyl-5-methylidenepyrrolidin-3-yl)ethanone;N-[4-(4-methyl-2-pyrazin-2-yl-1,3-thiazol-5-yl)-1,3-thiazol-2-yl]-N-(3-morpholin-4-ylpropyl)thiophene-2-carboxamide;sulfane
• SMILES: C=C1CC(C(=O)Cc2nc(-c3sc(C)nc3C)cs2)CN1C.Cc1ccc(C[C@H](C)CN(C(=O)OC(C)(C)C)c2nc(-c3cnco3)c(-c3ccc4cnccc4c3)s2)cc1.Cc1nc(-c2cnccn2)sc1-c1csc(N(CCCN2CCOCC2)C(=O)c2cccs2)n1.Cc1nc(SCC(=O)NC2CCN(Cc3ccc(Cl)c(Cl)c3)CC2)sc1-c1csc(CC(N)=O)n1.Cc1ncc(-c2nc(NC(=O)c3cnc(OCO)c(Cl)c3)sc2N2CCN(C3CCCCC3)CC2)[nH]1.Cc1ncc(-c2nc(NC(=O)c3cnc(OCO)c(Cl)c3)sc2N2CCN(C3CCCCC3)CC2)o1.Cc1ncc(-c2nc(NC(=O)c3cnc(OCO)c(Cl)c3)sc2N2CCN(C3CCCCC3)CC2)s1.S
• InChI: InChI=1S/C31H32N4O3S.C24H30ClN7O3S.C24H29ClN6O4S.C24H29ClN6O3S2.C23H25Cl2N5O2S3.C23H24N6O2S3.C16H19N3OS2.H2S/c1-20-6-8-22(9-7-20)14-21(2)18-35(30(36)38-31(3,4)5)29-34-27(26-17-33-19-37-26)28(39-29)24-10-11-25-16-32-13-12-23(25)15-24;1-15-26-13-19(28-15)20-23(32-9-7-31(8-10-32)17-5-3-2-4-6-17)36-24(29-20)30-21(34)16-11-18(25)22(27-12-16)35-14-33;2*1-15-26-13-19(35-15)20-23(31-9-7-30(8-10-31)17-5-3-2-4-6-17)36-24(28-20)29-21(33)16-11-18(25)22(27-12-16)34-14-32;1-13-22(18-11-33-21(29-18)9-19(26)31)35-23(27-13)34-12-20(32)28-15-4-6-30(7-5-15)10-14-2-3-16(24)17(25)8-14;1-16-20(34-21(26-16)17-14-24-5-6-25-17)18-15-33-23(27-18)29(22(30)19-4-2-13-32-19)8-3-7-28-9-11-31-12-10-28;1-9-5-12(7-19(9)4)14(20)6-15-18-13(8-21-15)16-10(2)17-11(3)22-16;/h6-13,15-17,19,21H,14,18H2,1-5H3;11-13,17,33H,2-10,14H2,1H3,(H,26,28)(H,29,30,34);2*11-13,17,32H,2-10,14H2,1H3,(H,28,29,33);2-3,8,11,15H,4-7,9-10,12H2,1H3,(H2,26,31)(H,28,32);2,4-6,13-15H,3,7-12H2,1H3;8,12H,1,5-7H2,2-4H3;1H2/t21-;;;;;;;/m0......./s1
• InChIKey: KZYIOAPXSSNAMB-YRXRNLCKSA-N
• XLogP: 33.54
• TPSA: 653.05 Ų
• H-Bond Donors: 9
• H-Bond Acceptors: 60
• Rotatable Bonds: 49
• Heavy Atoms: 239
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	3605.78
LogP ≤ 5	33.54
H-Bond Donors ≤ 5	9
H-Bond Acceptors ≤ 10	60

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of tert-butyl N-[5-isoquinolin-6-yl-4-(1,3-oxazol-5-yl)-1,3-thiazol-2-yl]-N-[(2S)-2-methyl-3-(4-methylphenyl)propyl]carbamate;5-chloro-N-[5-(4-cyclohexylpiperazin-1-yl)-4-(2-methyl-1H-imidazol-5-yl)-1,3-thiazol-2-yl]-6-(hydroxymethoxy)pyridine-3-carboxamide;5-chloro-N-[5-(4-cyclohexylpiperazin-1-yl)-4-(2-methyl-1,3-oxazol-5-yl)-1,3-thiazol-2-yl]-6-(hydroxymethoxy)pyridine-3-carboxamide;5-chloro-N-[5-(4-cyclohexylpiperazin-1-yl)-4-(2-methyl-1,3-thiazol-5-yl)-1,3-thiazol-2-yl]-6-(hydroxymethoxy)pyridine-3-carboxamide;2-[4-[2-[2-[[1-[(3,4-dichlorophenyl)methyl]piperidin-4-yl]amino]-2-oxoethyl]sulfanyl-4-methyl-1,3-thiazol-5-yl]-1,3-thiazol-2-yl]acetamide;2-[4-(2,4-dimethyl-1,3-thiazol-5-yl)-1,3-thiazol-2-yl]-1-(1-methyl-5-methylidenepyrrolidin-3-yl)ethanone;N-[4-(4-methyl-2-pyrazin-2-yl-1,3-thiazol-5-yl)-1,3-thiazol-2-yl]-N-(3-morpholin-4-ylpropyl)thiophene-2-carboxamide;sulfane?

The IUPAC name of tert-butyl N-[5-isoquinolin-6-yl-4-(1,3-oxazol-5-yl)-1,3-thiazol-2-yl]-N-[(2S)-2-methyl-3-(4-methylphenyl)propyl]carbamate;5-chloro-N-[5-(4-cyclohexylpiperazin-1-yl)-4-(2-methyl-1H-imidazol-5-yl)-1,3-thiazol-2-yl]-6-(hydroxymethoxy)pyridine-3-carboxamide;5-chloro-N-[5-(4-cyclohexylpiperazin-1-yl)-4-(2-methyl-1,3-oxazol-5-yl)-1,3-thiazol-2-yl]-6-(hydroxymethoxy)pyridine-3-carboxamide;5-chloro-N-[5-(4-cyclohexylpiperazin-1-yl)-4-(2-methyl-1,3-thiazol-5-yl)-1,3-thiazol-2-yl]-6-(hydroxymethoxy)pyridine-3-carboxamide;2-[4-[2-[2-[[1-[(3,4-dichlorophenyl)methyl]piperidin-4-yl]amino]-2-oxoethyl]sulfanyl-4-methyl-1,3-thiazol-5-yl]-1,3-thiazol-2-yl]acetamide;2-[4-(2,4-dimethyl-1,3-thiazol-5-yl)-1,3-thiazol-2-yl]-1-(1-methyl-5-methylidenepyrrolidin-3-yl)ethanone;N-[4-(4-methyl-2-pyrazin-2-yl-1,3-thiazol-5-yl)-1,3-thiazol-2-yl]-N-(3-morpholin-4-ylpropyl)thiophene-2-carboxamide;sulfane (CID 159289652) is tert-butyl N-[5-isoquinolin-6-yl-4-(1,3-oxazol-5-yl)-1,3-thiazol-2-yl]-N-[(2S)-2-methyl-3-(4-methylphenyl)propyl]carbamate;5-chloro-N-[5-(4-cyclohexylpiperazin-1-yl)-4-(2-methyl-1H-imidazol-5-yl)-1,3-thiazol-2-yl]-6-(hydroxymethoxy)pyridine-3-carboxamide;5-chloro-N-[5-(4-cyclohexylpiperazin-1-yl)-4-(2-methyl-1,3-oxazol-5-yl)-1,3-thiazol-2-yl]-6-(hydroxymethoxy)pyridine-3-carboxamide;5-chloro-N-[5-(4-cyclohexylpiperazin-1-yl)-4-(2-methyl-1,3-thiazol-5-yl)-1,3-thiazol-2-yl]-6-(hydroxymethoxy)pyridine-3-carboxamide;2-[4-[2-[2-[[1-[(3,4-dichlorophenyl)methyl]piperidin-4-yl]amino]-2-oxoethyl]sulfanyl-4-methyl-1,3-thiazol-5-yl]-1,3-thiazol-2-yl]acetamide;2-[4-(2,4-dimethyl-1,3-thiazol-5-yl)-1,3-thiazol-2-yl]-1-(1-methyl-5-methylidenepyrrolidin-3-yl)ethanone;N-[4-(4-methyl-2-pyrazin-2-yl-1,3-thiazol-5-yl)-1,3-thiazol-2-yl]-N-(3-morpholin-4-ylpropyl)thiophene-2-carboxamide;sulfane.

What is the SMILES notation for tert-butyl N-[5-isoquinolin-6-yl-4-(1,3-oxazol-5-yl)-1,3-thiazol-2-yl]-N-[(2S)-2-methyl-3-(4-methylphenyl)propyl]carbamate;5-chloro-N-[5-(4-cyclohexylpiperazin-1-yl)-4-(2-methyl-1H-imidazol-5-yl)-1,3-thiazol-2-yl]-6-(hydroxymethoxy)pyridine-3-carboxamide;5-chloro-N-[5-(4-cyclohexylpiperazin-1-yl)-4-(2-methyl-1,3-oxazol-5-yl)-1,3-thiazol-2-yl]-6-(hydroxymethoxy)pyridine-3-carboxamide;5-chloro-N-[5-(4-cyclohexylpiperazin-1-yl)-4-(2-methyl-1,3-thiazol-5-yl)-1,3-thiazol-2-yl]-6-(hydroxymethoxy)pyridine-3-carboxamide;2-[4-[2-[2-[[1-[(3,4-dichlorophenyl)methyl]piperidin-4-yl]amino]-2-oxoethyl]sulfanyl-4-methyl-1,3-thiazol-5-yl]-1,3-thiazol-2-yl]acetamide;2-[4-(2,4-dimethyl-1,3-thiazol-5-yl)-1,3-thiazol-2-yl]-1-(1-methyl-5-methylidenepyrrolidin-3-yl)ethanone;N-[4-(4-methyl-2-pyrazin-2-yl-1,3-thiazol-5-yl)-1,3-thiazol-2-yl]-N-(3-morpholin-4-ylpropyl)thiophene-2-carboxamide;sulfane?

The canonical SMILES for tert-butyl N-[5-isoquinolin-6-yl-4-(1,3-oxazol-5-yl)-1,3-thiazol-2-yl]-N-[(2S)-2-methyl-3-(4-methylphenyl)propyl]carbamate;5-chloro-N-[5-(4-cyclohexylpiperazin-1-yl)-4-(2-methyl-1H-imidazol-5-yl)-1,3-thiazol-2-yl]-6-(hydroxymethoxy)pyridine-3-carboxamide;5-chloro-N-[5-(4-cyclohexylpiperazin-1-yl)-4-(2-methyl-1,3-oxazol-5-yl)-1,3-thiazol-2-yl]-6-(hydroxymethoxy)pyridine-3-carboxamide;5-chloro-N-[5-(4-cyclohexylpiperazin-1-yl)-4-(2-methyl-1,3-thiazol-5-yl)-1,3-thiazol-2-yl]-6-(hydroxymethoxy)pyridine-3-carboxamide;2-[4-[2-[2-[[1-[(3,4-dichlorophenyl)methyl]piperidin-4-yl]amino]-2-oxoethyl]sulfanyl-4-methyl-1,3-thiazol-5-yl]-1,3-thiazol-2-yl]acetamide;2-[4-(2,4-dimethyl-1,3-thiazol-5-yl)-1,3-thiazol-2-yl]-1-(1-methyl-5-methylidenepyrrolidin-3-yl)ethanone;N-[4-(4-methyl-2-pyrazin-2-yl-1,3-thiazol-5-yl)-1,3-thiazol-2-yl]-N-(3-morpholin-4-ylpropyl)thiophene-2-carboxamide;sulfane is C=C1CC(C(=O)Cc2nc(-c3sc(C)nc3C)cs2)CN1C.Cc1ccc(C[C@H](C)CN(C(=O)OC(C)(C)C)c2nc(-c3cnco3)c(-c3ccc4cnccc4c3)s2)cc1.Cc1nc(-c2cnccn2)sc1-c1csc(N(CCCN2CCOCC2)C(=O)c2cccs2)n1.Cc1nc(SCC(=O)NC2CCN(Cc3ccc(Cl)c(Cl)c3)CC2)sc1-c1csc(CC(N)=O)n1.Cc1ncc(-c2nc(NC(=O)c3cnc(OCO)c(Cl)c3)sc2N2CCN(C3CCCCC3)CC2)[nH]1.Cc1ncc(-c2nc(NC(=O)c3cnc(OCO)c(Cl)c3)sc2N2CCN(C3CCCCC3)CC2)o1.Cc1ncc(-c2nc(NC(=O)c3cnc(OCO)c(Cl)c3)sc2N2CCN(C3CCCCC3)CC2)s1.S.

What is the InChIKey of tert-butyl N-[5-isoquinolin-6-yl-4-(1,3-oxazol-5-yl)-1,3-thiazol-2-yl]-N-[(2S)-2-methyl-3-(4-methylphenyl)propyl]carbamate;5-chloro-N-[5-(4-cyclohexylpiperazin-1-yl)-4-(2-methyl-1H-imidazol-5-yl)-1,3-thiazol-2-yl]-6-(hydroxymethoxy)pyridine-3-carboxamide;5-chloro-N-[5-(4-cyclohexylpiperazin-1-yl)-4-(2-methyl-1,3-oxazol-5-yl)-1,3-thiazol-2-yl]-6-(hydroxymethoxy)pyridine-3-carboxamide;5-chloro-N-[5-(4-cyclohexylpiperazin-1-yl)-4-(2-methyl-1,3-thiazol-5-yl)-1,3-thiazol-2-yl]-6-(hydroxymethoxy)pyridine-3-carboxamide;2-[4-[2-[2-[[1-[(3,4-dichlorophenyl)methyl]piperidin-4-yl]amino]-2-oxoethyl]sulfanyl-4-methyl-1,3-thiazol-5-yl]-1,3-thiazol-2-yl]acetamide;2-[4-(2,4-dimethyl-1,3-thiazol-5-yl)-1,3-thiazol-2-yl]-1-(1-methyl-5-methylidenepyrrolidin-3-yl)ethanone;N-[4-(4-methyl-2-pyrazin-2-yl-1,3-thiazol-5-yl)-1,3-thiazol-2-yl]-N-(3-morpholin-4-ylpropyl)thiophene-2-carboxamide;sulfane?

The InChIKey is KZYIOAPXSSNAMB-YRXRNLCKSA-N. The full InChI is InChI=1S/C31H32N4O3S.C24H30ClN7O3S.C24H29ClN6O4S.C24H29ClN6O3S2.C23H25Cl2N5O2S3.C23H24N6O2S3.C16H19N3OS2.H2S/c1-20-6-8-22(9-7-20)14-21(2)18-35(30(36)38-31(3,4)5)29-34-27(26-17-33-19-37-26)28(39-29)24-10-11-25-16-32-13-12-23(25)15-24;1-15-26-13-19(28-15)20-23(32-9-7-31(8-10-32)17-5-3-2-4-6-17)36-24(29-20)30-21(34)16-11-18(25)22(27-12-16)35-14-33;2*1-15-26-13-19(35-15)20-23(31-9-7-30(8-10-31)17-5-3-2-4-6-17)36-24(28-20)29-21(33)16-11-18(25)22(27-12-16)34-14-32;1-13-22(18-11-33-21(29-18)9-19(26)31)35-23(27-13)34-12-20(32)28-15-4-6-30(7-5-15)10-14-2-3-16(24)17(25)8-14;1-16-20(34-21(26-16)17-14-24-5-6-25-17)18-15-33-23(27-18)29(22(30)19-4-2-13-32-19)8-3-7-28-9-11-31-12-10-28;1-9-5-12(7-19(9)4)14(20)6-15-18-13(8-21-15)16-10(2)17-11(3)22-16;/h6-13,15-17,19,21H,14,18H2,1-5H3;11-13,17,33H,2-10,14H2,1H3,(H,26,28)(H,29,30,34);2*11-13,17,32H,2-10,14H2,1H3,(H,28,29,33);2-3,8,11,15H,4-7,9-10,12H2,1H3,(H2,26,31)(H,28,32);2,4-6,13-15H,3,7-12H2,1H3;8,12H,1,5-7H2,2-4H3;1H2/t21-;;;;;;;/m0......./s1.

What are the key properties of tert-butyl N-[5-isoquinolin-6-yl-4-(1,3-oxazol-5-yl)-1,3-thiazol-2-yl]-N-[(2S)-2-methyl-3-(4-methylphenyl)propyl]carbamate;5-chloro-N-[5-(4-cyclohexylpiperazin-1-yl)-4-(2-methyl-1H-imidazol-5-yl)-1,3-thiazol-2-yl]-6-(hydroxymethoxy)pyridine-3-carboxamide;5-chloro-N-[5-(4-cyclohexylpiperazin-1-yl)-4-(2-methyl-1,3-oxazol-5-yl)-1,3-thiazol-2-yl]-6-(hydroxymethoxy)pyridine-3-carboxamide;5-chloro-N-[5-(4-cyclohexylpiperazin-1-yl)-4-(2-methyl-1,3-thiazol-5-yl)-1,3-thiazol-2-yl]-6-(hydroxymethoxy)pyridine-3-carboxamide;2-[4-[2-[2-[[1-[(3,4-dichlorophenyl)methyl]piperidin-4-yl]amino]-2-oxoethyl]sulfanyl-4-methyl-1,3-thiazol-5-yl]-1,3-thiazol-2-yl]acetamide;2-[4-(2,4-dimethyl-1,3-thiazol-5-yl)-1,3-thiazol-2-yl]-1-(1-methyl-5-methylidenepyrrolidin-3-yl)ethanone;N-[4-(4-methyl-2-pyrazin-2-yl-1,3-thiazol-5-yl)-1,3-thiazol-2-yl]-N-(3-morpholin-4-ylpropyl)thiophene-2-carboxamide;sulfane?

tert-butyl N-[5-isoquinolin-6-yl-4-(1,3-oxazol-5-yl)-1,3-thiazol-2-yl]-N-[(2S)-2-methyl-3-(4-methylphenyl)propyl]carbamate;5-chloro-N-[5-(4-cyclohexylpiperazin-1-yl)-4-(2-methyl-1H-imidazol-5-yl)-1,3-thiazol-2-yl]-6-(hydroxymethoxy)pyridine-3-carboxamide;5-chloro-N-[5-(4-cyclohexylpiperazin-1-yl)-4-(2-methyl-1,3-oxazol-5-yl)-1,3-thiazol-2-yl]-6-(hydroxymethoxy)pyridine-3-carboxamide;5-chloro-N-[5-(4-cyclohexylpiperazin-1-yl)-4-(2-methyl-1,3-thiazol-5-yl)-1,3-thiazol-2-yl]-6-(hydroxymethoxy)pyridine-3-carboxamide;2-[4-[2-[2-[[1-[(3,4-dichlorophenyl)methyl]piperidin-4-yl]amino]-2-oxoethyl]sulfanyl-4-methyl-1,3-thiazol-5-yl]-1,3-thiazol-2-yl]acetamide;2-[4-(2,4-dimethyl-1,3-thiazol-5-yl)-1,3-thiazol-2-yl]-1-(1-methyl-5-methylidenepyrrolidin-3-yl)ethanone;N-[4-(4-methyl-2-pyrazin-2-yl-1,3-thiazol-5-yl)-1,3-thiazol-2-yl]-N-(3-morpholin-4-ylpropyl)thiophene-2-carboxamide;sulfane has a molecular weight of 3605.78 g/mol, XLogP of 33.54, 49 rotatable bonds, 9 hydrogen bond donors, and 60 hydrogen bond acceptors.

Where does this data come from?

All data for tert-butyl N-[5-isoquinolin-6-yl-4-(1,3-oxazol-5-yl)-1,3-thiazol-2-yl]-N-[(2S)-2-methyl-3-(4-methylphenyl)propyl]carbamate;5-chloro-N-[5-(4-cyclohexylpiperazin-1-yl)-4-(2-methyl-1H-imidazol-5-yl)-1,3-thiazol-2-yl]-6-(hydroxymethoxy)pyridine-3-carboxamide;5-chloro-N-[5-(4-cyclohexylpiperazin-1-yl)-4-(2-methyl-1,3-oxazol-5-yl)-1,3-thiazol-2-yl]-6-(hydroxymethoxy)pyridine-3-carboxamide;5-chloro-N-[5-(4-cyclohexylpiperazin-1-yl)-4-(2-methyl-1,3-thiazol-5-yl)-1,3-thiazol-2-yl]-6-(hydroxymethoxy)pyridine-3-carboxamide;2-[4-[2-[2-[[1-[(3,4-dichlorophenyl)methyl]piperidin-4-yl]amino]-2-oxoethyl]sulfanyl-4-methyl-1,3-thiazol-5-yl]-1,3-thiazol-2-yl]acetamide;2-[4-(2,4-dimethyl-1,3-thiazol-5-yl)-1,3-thiazol-2-yl]-1-(1-methyl-5-methylidenepyrrolidin-3-yl)ethanone;N-[4-(4-methyl-2-pyrazin-2-yl-1,3-thiazol-5-yl)-1,3-thiazol-2-yl]-N-(3-morpholin-4-ylpropyl)thiophene-2-carboxamide;sulfane is sourced from PubChem (CID 159289652), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).