3-[[4-[[(1R)-1-(1,3-benzodioxol-5-yl)-2,2-dimethylpropyl]amino]-1,2,5-thiadiazol-3-yl]amino]-N-benzyl-2-hydroxy-N-methylbenzamide;3-[[4-[[(1R)-1-(1,3-benzodioxol-5-yl)-2,2-dimethylpropyl]amino]-1,2,5-thiadiazol-3-yl]amino]-6-tert-butyl-2-hydroxy-N,N-dimethylbenzamide;3-[[4-[[(1R)-1-(1,3-benzodioxol-5-yl)-2,2-dimethylpropyl]amino]-1,2,5-thiadiazol-3-yl]amino]-6-ethyl-2-hydroxy-N,N-dimethylbenzamide;[3-[[4-[[(1R)-1-(1,3-benzodioxol-5-yl)-2,2-dimethylpropyl]amino]-1,2,5-thiadiazol-3-yl]amino]-2-hydroxyphenyl]-(4-pyridin-2-ylpiperazin-1-yl)methanone;[3-[[4-[[(1R)-1-(1,3-benzodioxol-5-yl)-2,2-dimethylpropyl]amino]-1,2,5-thiadiazol-3-yl]amino]-2-hydroxyphenyl]-(4-pyrimidin-2-ylpiperazin-1-yl)methanone;3-[[4-[[(1R)-1-(1,3-benzodioxol-5-yl)-2,2-dimethylpropyl]amino]-1,2,5-thiadiazol-3-yl]amino]-2-hydroxy-N,N,6-trimethylbenzamide

C164H191N35O24S6 — CID 161441802

About 3-[[4-[[(1R)-1-(1,3-benzodioxol-5-yl)-2,2-dimethylpropyl]amino]-1,2,5-thiadiazol-3-yl]amino]-N-benzyl-2-hydroxy-N-methylbenzamide;3-[[4-[[(1R)-1-(1,3-benzodioxol-5-yl)-2,2-dimethylpropyl]amino]-1,2,5-thiadiazol-3-yl]amino]-6-tert-butyl-2-hydroxy-N,N-dimethylbenzamide;3-[[4-[[(1R)-1-(1,3-benzodioxol-5-yl)-2,2-dimethylpropyl]amino]-1,2,5-thiadiazol-3-yl]amino]-6-ethyl-2-hydroxy-N,N-dimethylbenzamide;[3-[[4-[[(1R)-1-(1,3-benzodioxol-5-yl)-2,2-dimethylpropyl]amino]-1,2,5-thiadiazol-3-yl]amino]-2-hydroxyphenyl]-(4-pyridin-2-ylpiperazin-1-yl)methanone;[3-[[4-[[(1R)-1-(1,3-benzodioxol-5-yl)-2,2-dimethylpropyl]amino]-1,2,5-thiadiazol-3-yl]amino]-2-hydroxyphenyl]-(4-pyrimidin-2-ylpiperazin-1-yl)methanone;3-[[4-[[(1R)-1-(1,3-benzodioxol-5-yl)-2,2-dimethylpropyl]amino]-1,2,5-thiadiazol-3-yl]amino]-2-hydroxy-N,N,6-trimethylbenzamide

3-[[4-[[(1R)-1-(1,3-benzodioxol-5-yl)-2,2-dimethylpropyl]amino]-1,2,5-thiadiazol-3-yl]amino]-N-benzyl-2-hydroxy-N-methylbenzamide;3-[[4-[[(1R)-1-(1,3-benzodioxol-5-yl)-2,2-dimethylpropyl]amino]-1,2,5-thiadiazol-3-yl]amino]-6-tert-butyl-2-hydroxy-N,N-dimethylbenzamide;3-[[4-[[(1R)-1-(1,3-benzodioxol-5-yl)-2,2-dimethylpropyl]amino]-1,2,5-thiadiazol-3-yl]amino]-6-ethyl-2-hydroxy-N,N-dimethylbenzamide;[3-[[4-[[(1R)-1-(1,3-benzodioxol-5-yl)-2,2-dimethylpropyl]amino]-1,2,5-thiadiazol-3-yl]amino]-2-hydroxyphenyl]-(4-pyridin-2-ylpiperazin-1-yl)methanone;[3-[[4-[[(1R)-1-(1,3-benzodioxol-5-yl)-2,2-dimethylpropyl]amino]-1,2,5-thiadiazol-3-yl]amino]-2-hydroxyphenyl]-(4-pyrimidin-2-ylpiperazin-1-yl)methanone;3-[[4-[[(1R)-1-(1,3-benzodioxol-5-yl)-2,2-dimethylpropyl]amino]-1,2,5-thiadiazol-3-yl]amino]-2-hydroxy-N,N,6-trimethylbenzamide (PubChem CID 161441802) has the molecular formula C164H191N35O24S6 and a molecular weight of 3228.95 g/mol. Its IUPAC name is 3-[[4-[[(1R)-1-(1,3-benzodioxol-5-yl)-2,2-dimethylpropyl]amino]-1,2,5-thiadiazol-3-yl]amino]-N-benzyl-2-hydroxy-N-methylbenzamide;3-[[4-[[(1R)-1-(1,3-benzodioxol-5-yl)-2,2-dimethylpropyl]amino]-1,2,5-thiadiazol-3-yl]amino]-6-tert-butyl-2-hydroxy-N,N-dimethylbenzamide;3-[[4-[[(1R)-1-(1,3-benzodioxol-5-yl)-2,2-dimethylpropyl]amino]-1,2,5-thiadiazol-3-yl]amino]-6-ethyl-2-hydroxy-N,N-dimethylbenzamide;[3-[[4-[[(1R)-1-(1,3-benzodioxol-5-yl)-2,2-dimethylpropyl]amino]-1,2,5-thiadiazol-3-yl]amino]-2-hydroxyphenyl]-(4-pyridin-2-ylpiperazin-1-yl)methanone;[3-[[4-[[(1R)-1-(1,3-benzodioxol-5-yl)-2,2-dimethylpropyl]amino]-1,2,5-thiadiazol-3-yl]amino]-2-hydroxyphenyl]-(4-pyrimidin-2-ylpiperazin-1-yl)methanone;3-[[4-[[(1R)-1-(1,3-benzodioxol-5-yl)-2,2-dimethylpropyl]amino]-1,2,5-thiadiazol-3-yl]amino]-2-hydroxy-N,N,6-trimethylbenzamide.

Molecular Properties

• Compound Name: 3-[[4-[[(1R)-1-(1,3-benzodioxol-5-yl)-2,2-dimethylpropyl]amino]-1,2,5-thiadiazol-3-yl]amino]-N-benzyl-2-hydroxy-N-methylbenzamide;3-[[4-[[(1R)-1-(1,3-benzodioxol-5-yl)-2,2-dimethylpropyl]amino]-1,2,5-thiadiazol-3-yl]amino]-6-tert-butyl-2-hydroxy-N,N-dimethylbenzamide;3-[[4-[[(1R)-1-(1,3-benzodioxol-5-yl)-2,2-dimethylpropyl]amino]-1,2,5-thiadiazol-3-yl]amino]-6-ethyl-2-hydroxy-N,N-dimethylbenzamide;[3-[[4-[[(1R)-1-(1,3-benzodioxol-5-yl)-2,2-dimethylpropyl]amino]-1,2,5-thiadiazol-3-yl]amino]-2-hydroxyphenyl]-(4-pyridin-2-ylpiperazin-1-yl)methanone;[3-[[4-[[(1R)-1-(1,3-benzodioxol-5-yl)-2,2-dimethylpropyl]amino]-1,2,5-thiadiazol-3-yl]amino]-2-hydroxyphenyl]-(4-pyrimidin-2-ylpiperazin-1-yl)methanone;3-[[4-[[(1R)-1-(1,3-benzodioxol-5-yl)-2,2-dimethylpropyl]amino]-1,2,5-thiadiazol-3-yl]amino]-2-hydroxy-N,N,6-trimethylbenzamide
• PubChem CID: 161441802
• Molecular Formula: C164H191N35O24S6
• Molecular Weight: 3228.95 g/mol
• Exact Mass: 3226.31
• IUPAC Name: 3-[[4-[[(1R)-1-(1,3-benzodioxol-5-yl)-2,2-dimethylpropyl]amino]-1,2,5-thiadiazol-3-yl]amino]-N-benzyl-2-hydroxy-N-methylbenzamide;3-[[4-[[(1R)-1-(1,3-benzodioxol-5-yl)-2,2-dimethylpropyl]amino]-1,2,5-thiadiazol-3-yl]amino]-6-tert-butyl-2-hydroxy-N,N-dimethylbenzamide;3-[[4-[[(1R)-1-(1,3-benzodioxol-5-yl)-2,2-dimethylpropyl]amino]-1,2,5-thiadiazol-3-yl]amino]-6-ethyl-2-hydroxy-N,N-dimethylbenzamide;[3-[[4-[[(1R)-1-(1,3-benzodioxol-5-yl)-2,2-dimethylpropyl]amino]-1,2,5-thiadiazol-3-yl]amino]-2-hydroxyphenyl]-(4-pyridin-2-ylpiperazin-1-yl)methanone;[3-[[4-[[(1R)-1-(1,3-benzodioxol-5-yl)-2,2-dimethylpropyl]amino]-1,2,5-thiadiazol-3-yl]amino]-2-hydroxyphenyl]-(4-pyrimidin-2-ylpiperazin-1-yl)methanone;3-[[4-[[(1R)-1-(1,3-benzodioxol-5-yl)-2,2-dimethylpropyl]amino]-1,2,5-thiadiazol-3-yl]amino]-2-hydroxy-N,N,6-trimethylbenzamide
• SMILES: CC(C)(C)[C@@H](Nc1nsnc1Nc1cccc(C(=O)N2CCN(c3ccccn3)CC2)c1O)c1ccc2c(c1)OCO2.CC(C)(C)[C@@H](Nc1nsnc1Nc1cccc(C(=O)N2CCN(c3ncccn3)CC2)c1O)c1ccc2c(c1)OCO2.CCc1ccc(Nc2nsnc2N[C@@H](c2ccc3c(c2)OCO3)C(C)(C)C)c(O)c1C(=O)N(C)C.CN(C)C(=O)c1c(C(C)(C)C)ccc(Nc2nsnc2N[C@@H](c2ccc3c(c2)OCO3)C(C)(C)C)c1O.CN(Cc1ccccc1)C(=O)c1cccc(Nc2nsnc2N[C@@H](c2ccc3c(c2)OCO3)C(C)(C)C)c1O.Cc1ccc(Nc2nsnc2N[C@@H](c2ccc3c(c2)OCO3)C(C)(C)C)c(O)c1C(=O)N(C)C
• InChI: InChI=1S/C30H33N7O4S.C29H32N8O4S.C29H31N5O4S.C27H35N5O4S.C25H31N5O4S.C24H29N5O4S/c1-30(2,3)26(19-10-11-22-23(17-19)41-18-40-22)33-28-27(34-42-35-28)32-21-8-6-7-20(25(21)38)29(39)37-15-13-36(14-16-37)24-9-4-5-12-31-24;1-29(2,3)24(18-8-9-21-22(16-18)41-17-40-21)33-26-25(34-42-35-26)32-20-7-4-6-19(23(20)38)27(39)36-12-14-37(15-13-36)28-30-10-5-11-31-28;1-29(2,3)25(19-13-14-22-23(15-19)38-17-37-22)31-27-26(32-39-33-27)30-21-12-8-11-20(24(21)35)28(36)34(4)16-18-9-6-5-7-10-18;1-26(2,3)16-10-11-17(21(33)20(16)25(34)32(7)8)28-23-24(31-37-30-23)29-22(27(4,5)6)15-9-12-18-19(13-15)36-14-35-18;1-7-14-8-10-16(20(31)19(14)24(32)30(5)6)26-22-23(29-35-28-22)27-21(25(2,3)4)15-9-11-17-18(12-15)34-13-33-17;1-13-7-9-15(19(30)18(13)23(31)29(5)6)25-21-22(28-34-27-21)26-20(24(2,3)4)14-8-10-16-17(11-14)33-12-32-16/h4-12,17,26,38H,13-16,18H2,1-3H3,(H,32,34)(H,33,35);4-11,16,24,38H,12-15,17H2,1-3H3,(H,32,34)(H,33,35);5-15,25,35H,16-17H2,1-4H3,(H,30,32)(H,31,33);9-13,22,33H,14H2,1-8H3,(H,28,30)(H,29,31);8-12,21,31H,7,13H2,1-6H3,(H,26,28)(H,27,29);7-11,20,30H,12H2,1-6H3,(H,25,27)(H,26,28)/t26-;24-;25-;22-;21-;20-/m000000/s1
• InChIKey: VZJIMUFYDMMSGX-SZVOECQESA-N
• XLogP: 32.15
• TPSA: 698.19 Ų
• H-Bond Donors: 18
• H-Bond Acceptors: 59
• Rotatable Bonds: 41
• Heavy Atoms: 229
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	3228.95
LogP ≤ 5	32.15
H-Bond Donors ≤ 5	18
H-Bond Acceptors ≤ 10	59

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of 3-[[4-[[(1R)-1-(1,3-benzodioxol-5-yl)-2,2-dimethylpropyl]amino]-1,2,5-thiadiazol-3-yl]amino]-N-benzyl-2-hydroxy-N-methylbenzamide;3-[[4-[[(1R)-1-(1,3-benzodioxol-5-yl)-2,2-dimethylpropyl]amino]-1,2,5-thiadiazol-3-yl]amino]-6-tert-butyl-2-hydroxy-N,N-dimethylbenzamide;3-[[4-[[(1R)-1-(1,3-benzodioxol-5-yl)-2,2-dimethylpropyl]amino]-1,2,5-thiadiazol-3-yl]amino]-6-ethyl-2-hydroxy-N,N-dimethylbenzamide;[3-[[4-[[(1R)-1-(1,3-benzodioxol-5-yl)-2,2-dimethylpropyl]amino]-1,2,5-thiadiazol-3-yl]amino]-2-hydroxyphenyl]-(4-pyridin-2-ylpiperazin-1-yl)methanone;[3-[[4-[[(1R)-1-(1,3-benzodioxol-5-yl)-2,2-dimethylpropyl]amino]-1,2,5-thiadiazol-3-yl]amino]-2-hydroxyphenyl]-(4-pyrimidin-2-ylpiperazin-1-yl)methanone;3-[[4-[[(1R)-1-(1,3-benzodioxol-5-yl)-2,2-dimethylpropyl]amino]-1,2,5-thiadiazol-3-yl]amino]-2-hydroxy-N,N,6-trimethylbenzamide?

The IUPAC name of 3-[[4-[[(1R)-1-(1,3-benzodioxol-5-yl)-2,2-dimethylpropyl]amino]-1,2,5-thiadiazol-3-yl]amino]-N-benzyl-2-hydroxy-N-methylbenzamide;3-[[4-[[(1R)-1-(1,3-benzodioxol-5-yl)-2,2-dimethylpropyl]amino]-1,2,5-thiadiazol-3-yl]amino]-6-tert-butyl-2-hydroxy-N,N-dimethylbenzamide;3-[[4-[[(1R)-1-(1,3-benzodioxol-5-yl)-2,2-dimethylpropyl]amino]-1,2,5-thiadiazol-3-yl]amino]-6-ethyl-2-hydroxy-N,N-dimethylbenzamide;[3-[[4-[[(1R)-1-(1,3-benzodioxol-5-yl)-2,2-dimethylpropyl]amino]-1,2,5-thiadiazol-3-yl]amino]-2-hydroxyphenyl]-(4-pyridin-2-ylpiperazin-1-yl)methanone;[3-[[4-[[(1R)-1-(1,3-benzodioxol-5-yl)-2,2-dimethylpropyl]amino]-1,2,5-thiadiazol-3-yl]amino]-2-hydroxyphenyl]-(4-pyrimidin-2-ylpiperazin-1-yl)methanone;3-[[4-[[(1R)-1-(1,3-benzodioxol-5-yl)-2,2-dimethylpropyl]amino]-1,2,5-thiadiazol-3-yl]amino]-2-hydroxy-N,N,6-trimethylbenzamide (CID 161441802) is 3-[[4-[[(1R)-1-(1,3-benzodioxol-5-yl)-2,2-dimethylpropyl]amino]-1,2,5-thiadiazol-3-yl]amino]-N-benzyl-2-hydroxy-N-methylbenzamide;3-[[4-[[(1R)-1-(1,3-benzodioxol-5-yl)-2,2-dimethylpropyl]amino]-1,2,5-thiadiazol-3-yl]amino]-6-tert-butyl-2-hydroxy-N,N-dimethylbenzamide;3-[[4-[[(1R)-1-(1,3-benzodioxol-5-yl)-2,2-dimethylpropyl]amino]-1,2,5-thiadiazol-3-yl]amino]-6-ethyl-2-hydroxy-N,N-dimethylbenzamide;[3-[[4-[[(1R)-1-(1,3-benzodioxol-5-yl)-2,2-dimethylpropyl]amino]-1,2,5-thiadiazol-3-yl]amino]-2-hydroxyphenyl]-(4-pyridin-2-ylpiperazin-1-yl)methanone;[3-[[4-[[(1R)-1-(1,3-benzodioxol-5-yl)-2,2-dimethylpropyl]amino]-1,2,5-thiadiazol-3-yl]amino]-2-hydroxyphenyl]-(4-pyrimidin-2-ylpiperazin-1-yl)methanone;3-[[4-[[(1R)-1-(1,3-benzodioxol-5-yl)-2,2-dimethylpropyl]amino]-1,2,5-thiadiazol-3-yl]amino]-2-hydroxy-N,N,6-trimethylbenzamide.

What is the SMILES notation for 3-[[4-[[(1R)-1-(1,3-benzodioxol-5-yl)-2,2-dimethylpropyl]amino]-1,2,5-thiadiazol-3-yl]amino]-N-benzyl-2-hydroxy-N-methylbenzamide;3-[[4-[[(1R)-1-(1,3-benzodioxol-5-yl)-2,2-dimethylpropyl]amino]-1,2,5-thiadiazol-3-yl]amino]-6-tert-butyl-2-hydroxy-N,N-dimethylbenzamide;3-[[4-[[(1R)-1-(1,3-benzodioxol-5-yl)-2,2-dimethylpropyl]amino]-1,2,5-thiadiazol-3-yl]amino]-6-ethyl-2-hydroxy-N,N-dimethylbenzamide;[3-[[4-[[(1R)-1-(1,3-benzodioxol-5-yl)-2,2-dimethylpropyl]amino]-1,2,5-thiadiazol-3-yl]amino]-2-hydroxyphenyl]-(4-pyridin-2-ylpiperazin-1-yl)methanone;[3-[[4-[[(1R)-1-(1,3-benzodioxol-5-yl)-2,2-dimethylpropyl]amino]-1,2,5-thiadiazol-3-yl]amino]-2-hydroxyphenyl]-(4-pyrimidin-2-ylpiperazin-1-yl)methanone;3-[[4-[[(1R)-1-(1,3-benzodioxol-5-yl)-2,2-dimethylpropyl]amino]-1,2,5-thiadiazol-3-yl]amino]-2-hydroxy-N,N,6-trimethylbenzamide?

The canonical SMILES for 3-[[4-[[(1R)-1-(1,3-benzodioxol-5-yl)-2,2-dimethylpropyl]amino]-1,2,5-thiadiazol-3-yl]amino]-N-benzyl-2-hydroxy-N-methylbenzamide;3-[[4-[[(1R)-1-(1,3-benzodioxol-5-yl)-2,2-dimethylpropyl]amino]-1,2,5-thiadiazol-3-yl]amino]-6-tert-butyl-2-hydroxy-N,N-dimethylbenzamide;3-[[4-[[(1R)-1-(1,3-benzodioxol-5-yl)-2,2-dimethylpropyl]amino]-1,2,5-thiadiazol-3-yl]amino]-6-ethyl-2-hydroxy-N,N-dimethylbenzamide;[3-[[4-[[(1R)-1-(1,3-benzodioxol-5-yl)-2,2-dimethylpropyl]amino]-1,2,5-thiadiazol-3-yl]amino]-2-hydroxyphenyl]-(4-pyridin-2-ylpiperazin-1-yl)methanone;[3-[[4-[[(1R)-1-(1,3-benzodioxol-5-yl)-2,2-dimethylpropyl]amino]-1,2,5-thiadiazol-3-yl]amino]-2-hydroxyphenyl]-(4-pyrimidin-2-ylpiperazin-1-yl)methanone;3-[[4-[[(1R)-1-(1,3-benzodioxol-5-yl)-2,2-dimethylpropyl]amino]-1,2,5-thiadiazol-3-yl]amino]-2-hydroxy-N,N,6-trimethylbenzamide is CC(C)(C)[C@@H](Nc1nsnc1Nc1cccc(C(=O)N2CCN(c3ccccn3)CC2)c1O)c1ccc2c(c1)OCO2.CC(C)(C)[C@@H](Nc1nsnc1Nc1cccc(C(=O)N2CCN(c3ncccn3)CC2)c1O)c1ccc2c(c1)OCO2.CCc1ccc(Nc2nsnc2N[C@@H](c2ccc3c(c2)OCO3)C(C)(C)C)c(O)c1C(=O)N(C)C.CN(C)C(=O)c1c(C(C)(C)C)ccc(Nc2nsnc2N[C@@H](c2ccc3c(c2)OCO3)C(C)(C)C)c1O.CN(Cc1ccccc1)C(=O)c1cccc(Nc2nsnc2N[C@@H](c2ccc3c(c2)OCO3)C(C)(C)C)c1O.Cc1ccc(Nc2nsnc2N[C@@H](c2ccc3c(c2)OCO3)C(C)(C)C)c(O)c1C(=O)N(C)C.

What is the InChIKey of 3-[[4-[[(1R)-1-(1,3-benzodioxol-5-yl)-2,2-dimethylpropyl]amino]-1,2,5-thiadiazol-3-yl]amino]-N-benzyl-2-hydroxy-N-methylbenzamide;3-[[4-[[(1R)-1-(1,3-benzodioxol-5-yl)-2,2-dimethylpropyl]amino]-1,2,5-thiadiazol-3-yl]amino]-6-tert-butyl-2-hydroxy-N,N-dimethylbenzamide;3-[[4-[[(1R)-1-(1,3-benzodioxol-5-yl)-2,2-dimethylpropyl]amino]-1,2,5-thiadiazol-3-yl]amino]-6-ethyl-2-hydroxy-N,N-dimethylbenzamide;[3-[[4-[[(1R)-1-(1,3-benzodioxol-5-yl)-2,2-dimethylpropyl]amino]-1,2,5-thiadiazol-3-yl]amino]-2-hydroxyphenyl]-(4-pyridin-2-ylpiperazin-1-yl)methanone;[3-[[4-[[(1R)-1-(1,3-benzodioxol-5-yl)-2,2-dimethylpropyl]amino]-1,2,5-thiadiazol-3-yl]amino]-2-hydroxyphenyl]-(4-pyrimidin-2-ylpiperazin-1-yl)methanone;3-[[4-[[(1R)-1-(1,3-benzodioxol-5-yl)-2,2-dimethylpropyl]amino]-1,2,5-thiadiazol-3-yl]amino]-2-hydroxy-N,N,6-trimethylbenzamide?

The InChIKey is VZJIMUFYDMMSGX-SZVOECQESA-N. The full InChI is InChI=1S/C30H33N7O4S.C29H32N8O4S.C29H31N5O4S.C27H35N5O4S.C25H31N5O4S.C24H29N5O4S/c1-30(2,3)26(19-10-11-22-23(17-19)41-18-40-22)33-28-27(34-42-35-28)32-21-8-6-7-20(25(21)38)29(39)37-15-13-36(14-16-37)24-9-4-5-12-31-24;1-29(2,3)24(18-8-9-21-22(16-18)41-17-40-21)33-26-25(34-42-35-26)32-20-7-4-6-19(23(20)38)27(39)36-12-14-37(15-13-36)28-30-10-5-11-31-28;1-29(2,3)25(19-13-14-22-23(15-19)38-17-37-22)31-27-26(32-39-33-27)30-21-12-8-11-20(24(21)35)28(36)34(4)16-18-9-6-5-7-10-18;1-26(2,3)16-10-11-17(21(33)20(16)25(34)32(7)8)28-23-24(31-37-30-23)29-22(27(4,5)6)15-9-12-18-19(13-15)36-14-35-18;1-7-14-8-10-16(20(31)19(14)24(32)30(5)6)26-22-23(29-35-28-22)27-21(25(2,3)4)15-9-11-17-18(12-15)34-13-33-17;1-13-7-9-15(19(30)18(13)23(31)29(5)6)25-21-22(28-34-27-21)26-20(24(2,3)4)14-8-10-16-17(11-14)33-12-32-16/h4-12,17,26,38H,13-16,18H2,1-3H3,(H,32,34)(H,33,35);4-11,16,24,38H,12-15,17H2,1-3H3,(H,32,34)(H,33,35);5-15,25,35H,16-17H2,1-4H3,(H,30,32)(H,31,33);9-13,22,33H,14H2,1-8H3,(H,28,30)(H,29,31);8-12,21,31H,7,13H2,1-6H3,(H,26,28)(H,27,29);7-11,20,30H,12H2,1-6H3,(H,25,27)(H,26,28)/t26-;24-;25-;22-;21-;20-/m000000/s1.

What are the key properties of 3-[[4-[[(1R)-1-(1,3-benzodioxol-5-yl)-2,2-dimethylpropyl]amino]-1,2,5-thiadiazol-3-yl]amino]-N-benzyl-2-hydroxy-N-methylbenzamide;3-[[4-[[(1R)-1-(1,3-benzodioxol-5-yl)-2,2-dimethylpropyl]amino]-1,2,5-thiadiazol-3-yl]amino]-6-tert-butyl-2-hydroxy-N,N-dimethylbenzamide;3-[[4-[[(1R)-1-(1,3-benzodioxol-5-yl)-2,2-dimethylpropyl]amino]-1,2,5-thiadiazol-3-yl]amino]-6-ethyl-2-hydroxy-N,N-dimethylbenzamide;[3-[[4-[[(1R)-1-(1,3-benzodioxol-5-yl)-2,2-dimethylpropyl]amino]-1,2,5-thiadiazol-3-yl]amino]-2-hydroxyphenyl]-(4-pyridin-2-ylpiperazin-1-yl)methanone;[3-[[4-[[(1R)-1-(1,3-benzodioxol-5-yl)-2,2-dimethylpropyl]amino]-1,2,5-thiadiazol-3-yl]amino]-2-hydroxyphenyl]-(4-pyrimidin-2-ylpiperazin-1-yl)methanone;3-[[4-[[(1R)-1-(1,3-benzodioxol-5-yl)-2,2-dimethylpropyl]amino]-1,2,5-thiadiazol-3-yl]amino]-2-hydroxy-N,N,6-trimethylbenzamide?

3-[[4-[[(1R)-1-(1,3-benzodioxol-5-yl)-2,2-dimethylpropyl]amino]-1,2,5-thiadiazol-3-yl]amino]-N-benzyl-2-hydroxy-N-methylbenzamide;3-[[4-[[(1R)-1-(1,3-benzodioxol-5-yl)-2,2-dimethylpropyl]amino]-1,2,5-thiadiazol-3-yl]amino]-6-tert-butyl-2-hydroxy-N,N-dimethylbenzamide;3-[[4-[[(1R)-1-(1,3-benzodioxol-5-yl)-2,2-dimethylpropyl]amino]-1,2,5-thiadiazol-3-yl]amino]-6-ethyl-2-hydroxy-N,N-dimethylbenzamide;[3-[[4-[[(1R)-1-(1,3-benzodioxol-5-yl)-2,2-dimethylpropyl]amino]-1,2,5-thiadiazol-3-yl]amino]-2-hydroxyphenyl]-(4-pyridin-2-ylpiperazin-1-yl)methanone;[3-[[4-[[(1R)-1-(1,3-benzodioxol-5-yl)-2,2-dimethylpropyl]amino]-1,2,5-thiadiazol-3-yl]amino]-2-hydroxyphenyl]-(4-pyrimidin-2-ylpiperazin-1-yl)methanone;3-[[4-[[(1R)-1-(1,3-benzodioxol-5-yl)-2,2-dimethylpropyl]amino]-1,2,5-thiadiazol-3-yl]amino]-2-hydroxy-N,N,6-trimethylbenzamide has a molecular weight of 3228.95 g/mol, XLogP of 32.15, 41 rotatable bonds, 18 hydrogen bond donors, and 59 hydrogen bond acceptors.

Where does this data come from?

All data for 3-[[4-[[(1R)-1-(1,3-benzodioxol-5-yl)-2,2-dimethylpropyl]amino]-1,2,5-thiadiazol-3-yl]amino]-N-benzyl-2-hydroxy-N-methylbenzamide;3-[[4-[[(1R)-1-(1,3-benzodioxol-5-yl)-2,2-dimethylpropyl]amino]-1,2,5-thiadiazol-3-yl]amino]-6-tert-butyl-2-hydroxy-N,N-dimethylbenzamide;3-[[4-[[(1R)-1-(1,3-benzodioxol-5-yl)-2,2-dimethylpropyl]amino]-1,2,5-thiadiazol-3-yl]amino]-6-ethyl-2-hydroxy-N,N-dimethylbenzamide;[3-[[4-[[(1R)-1-(1,3-benzodioxol-5-yl)-2,2-dimethylpropyl]amino]-1,2,5-thiadiazol-3-yl]amino]-2-hydroxyphenyl]-(4-pyridin-2-ylpiperazin-1-yl)methanone;[3-[[4-[[(1R)-1-(1,3-benzodioxol-5-yl)-2,2-dimethylpropyl]amino]-1,2,5-thiadiazol-3-yl]amino]-2-hydroxyphenyl]-(4-pyrimidin-2-ylpiperazin-1-yl)methanone;3-[[4-[[(1R)-1-(1,3-benzodioxol-5-yl)-2,2-dimethylpropyl]amino]-1,2,5-thiadiazol-3-yl]amino]-2-hydroxy-N,N,6-trimethylbenzamide is sourced from PubChem (CID 161441802), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).