1-[4-[[[(2S)-2-aminopropanoyl]amino]methyl]-1,3-thiazol-2-yl]-N-[(2-methoxyphenyl)methyl]-3-(trifluoromethyl)pyrazole-5-carboxamide;tert-butyl N-[(2S)-1-[[2-[5-(furan-2-yl)-3-(trifluoromethyl)pyrazol-1-yl]-1,3-thiazol-4-yl]methylamino]-1-oxopropan-2-yl]carbamate;tert-butyl N-[(2R)-1-[[2-[5-[(2-methoxyphenyl)methylcarbamoyl]-3-(trifluoromethyl)pyrazol-1-yl]-1,3-thiazol-4-yl]methylamino]-1-oxopropan-2-yl]carbamate;(2-methoxyphenyl)methanamine;1-[4-[[[(2S)-2-[(2-methylpropan-2-yl)oxycarbonylamino]propanoyl]amino]methyl]-1,3-thiazol-2-yl]-3-(trifluoromethyl)pyrazole-5-carboxylic acid

C90H103F12N23O18S4 — CID 158123291

IUPAC1-[4-[[[(2S)-2-aminopropanoyl]amino]methyl]-1,3-thiazol-2-yl]-N-[(2-methoxyphenyl)methyl]-3-(trifluoromethyl)pyrazole-5-carboxamide;tert-butyl N-[(2S)-1-[[2-[5-(furan-2-yl)-3-(trifluoromethyl)pyrazol-1-yl]-1,3-thiazol-4-yl]methylamino]-1-oxopropan-2-yl]carbamate;tert-butyl N-[(2R)-1-[[2-[5-[(2-methoxyphenyl)methylcarbamoyl]-3-(trifluoromethyl)pyrazol-1-yl]-1,3-thiazol-4-yl]methylamino]-1-oxopropan-2-yl]carbamate;(2-methoxyphenyl)methanamine;1-[4-[[[(2S)-2-[(2-methylpropan-2-yl)oxycarbonylamino]propanoyl]amino]methyl]-1,3-thiazol-2-yl]-3-(trifluoromethyl)pyrazole-5-carboxylic acid
SMILESCOc1ccccc1CN.COc1ccccc1CNC(=O)c1cc(C(F)(F)F)nn1-c1nc(CNC(=O)[C@@H](C)NC(=O)OC(C)(C)C)cs1.COc1ccccc1CNC(=O)c1cc(C(F)(F)F)nn1-c1nc(CNC(=O)[C@H](C)N)cs1.C[C@H](NC(=O)OC(C)(C)C)C(=O)NCc1csc(-n2nc(C(F)(F)F)cc2-c2ccco2)n1.C[C@H](NC(=O)OC(C)(C)C)C(=O)NCc1csc(-n2nc(C(F)(F)F)cc2C(=O)O)n1
InChIInChI=1S/C25H29F3N6O5S.C20H21F3N6O3S.C20H22F3N5O4S.C17H20F3N5O5S.C8H11NO/c1-14(31-23(37)39-24(2,3)4)20(35)30-12-16-13-40-22(32-16)34-17(10-19(33-34)25(26,27)28)21(36)29-11-15-8-6-7-9-18(15)38-5;1-11(24)17(30)26-9-13-10-33-19(27-13)29-14(7-16(28-29)20(21,22)23)18(31)25-8-12-5-3-4-6-15(12)32-2;1-11(25-18(30)32-19(2,3)4)16(29)24-9-12-10-33-17(26-12)28-13(14-6-5-7-31-14)8-15(27-28)20(21,22)23;1-8(22-15(29)30-16(2,3)4)12(26)21-6-9-7-31-14(23-9)25-10(13(27)28)5-11(24-25)17(18,19)20;1-10-8-5-3-2-4-7(8)6-9/h6-10,13-14H,11-12H2,1-5H3,(H,29,36)(H,30,35)(H,31,37);3-7,10-11H,8-9,24H2,1-2H3,(H,25,31)(H,26,30);5-8,10-11H,9H2,1-4H3,(H,24,29)(H,25,30);5,7-8H,6H2,1-4H3,(H,21,26)(H,22,29)(H,27,28);2-5H,6,9H2,1H3/t14-;2*11-;8-;/m1000./s1
InChIKeyFRVYXVYDTBECQM-WWXHBKQBSA-N
MW2151.20 g/mol
LogP13.93
Rot. Bonds31

About 1-[4-[[[(2S)-2-aminopropanoyl]amino]methyl]-1,3-thiazol-2-yl]-N-[(2-methoxyphenyl)methyl]-3-(trifluoromethyl)pyrazole-5-carboxamide;tert-butyl N-[(2S)-1-[[2-[5-(furan-2-yl)-3-(trifluoromethyl)pyrazol-1-yl]-1,3-thiazol-4-yl]methylamino]-1-oxopropan-2-yl]carbamate;tert-butyl N-[(2R)-1-[[2-[5-[(2-methoxyphenyl)methylcarbamoyl]-3-(trifluoromethyl)pyrazol-1-yl]-1,3-thiazol-4-yl]methylamino]-1-oxopropan-2-yl]carbamate;(2-methoxyphenyl)methanamine;1-[4-[[[(2S)-2-[(2-methylpropan-2-yl)oxycarbonylamino]propanoyl]amino]methyl]-1,3-thiazol-2-yl]-3-(trifluoromethyl)pyrazole-5-carboxylic acid

1-[4-[[[(2S)-2-aminopropanoyl]amino]methyl]-1,3-thiazol-2-yl]-N-[(2-methoxyphenyl)methyl]-3-(trifluoromethyl)pyrazole-5-carboxamide;tert-butyl N-[(2S)-1-[[2-[5-(furan-2-yl)-3-(trifluoromethyl)pyrazol-1-yl]-1,3-thiazol-4-yl]methylamino]-1-oxopropan-2-yl]carbamate;tert-butyl N-[(2R)-1-[[2-[5-[(2-methoxyphenyl)methylcarbamoyl]-3-(trifluoromethyl)pyrazol-1-yl]-1,3-thiazol-4-yl]methylamino]-1-oxopropan-2-yl]carbamate;(2-methoxyphenyl)methanamine;1-[4-[[[(2S)-2-[(2-methylpropan-2-yl)oxycarbonylamino]propanoyl]amino]methyl]-1,3-thiazol-2-yl]-3-(trifluoromethyl)pyrazole-5-carboxylic acid (PubChem CID 158123291) has the molecular formula C90H103F12N23O18S4 and a molecular weight of 2151.20 g/mol. Its IUPAC name is 1-[4-[[[(2S)-2-aminopropanoyl]amino]methyl]-1,3-thiazol-2-yl]-N-[(2-methoxyphenyl)methyl]-3-(trifluoromethyl)pyrazole-5-carboxamide;tert-butyl N-[(2S)-1-[[2-[5-(furan-2-yl)-3-(trifluoromethyl)pyrazol-1-yl]-1,3-thiazol-4-yl]methylamino]-1-oxopropan-2-yl]carbamate;tert-butyl N-[(2R)-1-[[2-[5-[(2-methoxyphenyl)methylcarbamoyl]-3-(trifluoromethyl)pyrazol-1-yl]-1,3-thiazol-4-yl]methylamino]-1-oxopropan-2-yl]carbamate;(2-methoxyphenyl)methanamine;1-[4-[[[(2S)-2-[(2-methylpropan-2-yl)oxycarbonylamino]propanoyl]amino]methyl]-1,3-thiazol-2-yl]-3-(trifluoromethyl)pyrazole-5-carboxylic acid.

Molecular Properties

Compound Name1-[4-[[[(2S)-2-aminopropanoyl]amino]methyl]-1,3-thiazol-2-yl]-N-[(2-methoxyphenyl)methyl]-3-(trifluoromethyl)pyrazole-5-carboxamide;tert-butyl N-[(2S)-1-[[2-[5-(furan-2-yl)-3-(trifluoromethyl)pyrazol-1-yl]-1,3-thiazol-4-yl]methylamino]-1-oxopropan-2-yl]carbamate;tert-butyl N-[(2R)-1-[[2-[5-[(2-methoxyphenyl)methylcarbamoyl]-3-(trifluoromethyl)pyrazol-1-yl]-1,3-thiazol-4-yl]methylamino]-1-oxopropan-2-yl]carbamate;(2-methoxyphenyl)methanamine;1-[4-[[[(2S)-2-[(2-methylpropan-2-yl)oxycarbonylamino]propanoyl]amino]methyl]-1,3-thiazol-2-yl]-3-(trifluoromethyl)pyrazole-5-carboxylic acid
PubChem CID158123291
Molecular FormulaC90H103F12N23O18S4
Molecular Weight2151.20 g/mol
Exact Mass2149.65
IUPAC Name1-[4-[[[(2S)-2-aminopropanoyl]amino]methyl]-1,3-thiazol-2-yl]-N-[(2-methoxyphenyl)methyl]-3-(trifluoromethyl)pyrazole-5-carboxamide;tert-butyl N-[(2S)-1-[[2-[5-(furan-2-yl)-3-(trifluoromethyl)pyrazol-1-yl]-1,3-thiazol-4-yl]methylamino]-1-oxopropan-2-yl]carbamate;tert-butyl N-[(2R)-1-[[2-[5-[(2-methoxyphenyl)methylcarbamoyl]-3-(trifluoromethyl)pyrazol-1-yl]-1,3-thiazol-4-yl]methylamino]-1-oxopropan-2-yl]carbamate;(2-methoxyphenyl)methanamine;1-[4-[[[(2S)-2-[(2-methylpropan-2-yl)oxycarbonylamino]propanoyl]amino]methyl]-1,3-thiazol-2-yl]-3-(trifluoromethyl)pyrazole-5-carboxylic acid
SMILESCOc1ccccc1CN.COc1ccccc1CNC(=O)c1cc(C(F)(F)F)nn1-c1nc(CNC(=O)[C@@H](C)NC(=O)OC(C)(C)C)cs1.COc1ccccc1CNC(=O)c1cc(C(F)(F)F)nn1-c1nc(CNC(=O)[C@H](C)N)cs1.C[C@H](NC(=O)OC(C)(C)C)C(=O)NCc1csc(-n2nc(C(F)(F)F)cc2-c2ccco2)n1.C[C@H](NC(=O)OC(C)(C)C)C(=O)NCc1csc(-n2nc(C(F)(F)F)cc2C(=O)O)n1
InChIInChI=1S/C25H29F3N6O5S.C20H21F3N6O3S.C20H22F3N5O4S.C17H20F3N5O5S.C8H11NO/c1-14(31-23(37)39-24(2,3)4)20(35)30-12-16-13-40-22(32-16)34-17(10-19(33-34)25(26,27)28)21(36)29-11-15-8-6-7-9-18(15)38-5;1-11(24)17(30)26-9-13-10-33-19(27-13)29-14(7-16(28-29)20(21,22)23)18(31)25-8-12-5-3-4-6-15(12)32-2;1-11(25-18(30)32-19(2,3)4)16(29)24-9-12-10-33-17(26-12)28-13(14-6-5-7-31-14)8-15(27-28)20(21,22)23;1-8(22-15(29)30-16(2,3)4)12(26)21-6-9-7-31-14(23-9)25-10(13(27)28)5-11(24-25)17(18,19)20;1-10-8-5-3-2-4-7(8)6-9/h6-10,13-14H,11-12H2,1-5H3,(H,29,36)(H,30,35)(H,31,37);3-7,10-11H,8-9,24H2,1-2H3,(H,25,31)(H,26,30);5-8,10-11H,9H2,1-4H3,(H,24,29)(H,25,30);5,7-8H,6H2,1-4H3,(H,21,26)(H,22,29)(H,27,28);2-5H,6,9H2,1H3/t14-;2*11-;8-;/m1000./s1
InChIKeyFRVYXVYDTBECQM-WWXHBKQBSA-N
XLogP13.93
TPSA542.60 Ų
H-Bond Donors12
H-Bond Acceptors35
Rotatable Bonds31
Heavy Atoms147
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5002151.20
LogP ≤ 513.93
H-Bond Donors ≤ 512
H-Bond Acceptors ≤ 1035

Computed Properties (RDKit)

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

Analyze 1-[4-[[[(2S)-2-aminopropanoyl]amino]methyl]-1,3-thiazol-2-yl]-N-[(2-methoxyphenyl)methyl]-3-(trifluoromethyl)pyrazole-5-carboxamide;tert-butyl N-[(2S)-1-[[2-[5-(furan-2-yl)-3-(trifluoromethyl)pyrazol-1-yl]-1,3-thiazol-4-yl]methylamino]-1-oxopropan-2-yl]carbamate;tert-butyl N-[(2R)-1-[[2-[5-[(2-methoxyphenyl)methylcarbamoyl]-3-(trifluoromethyl)pyrazol-1-yl]-1,3-thiazol-4-yl]methylamino]-1-oxopropan-2-yl]carbamate;(2-methoxyphenyl)methanamine;1-[4-[[[(2S)-2-[(2-methylpropan-2-yl)oxycarbonylamino]propanoyl]amino]methyl]-1,3-thiazol-2-yl]-3-(trifluoromethyl)pyrazole-5-carboxylic acid with MolForge

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Related Compounds

tert-butyl N-[(2S)-1-[[2-[5-(furan-2-yl)-3-(trifluoromethyl)pyrazol-1-yl]-1,3-thiazol-4-yl]methylamino]-1-oxopropan-2-yl]carbamate
CID 59843279
tert-butyl N-[1-[[2-[5-(furan-2-yl)-3-(trifluoromethyl)pyrazol-1-yl]-1,3-thiazol-4-yl]methylamino]-1-oxopropan-2-yl]carbamate
CID 69300619
1-[4-[[[(2S)-2-aminopropanoyl]amino]methyl]-2-pyridinyl]-N-[(2-methoxyphenyl)methyl]-3-(trifluoromethyl)pyrazole-5-carboxamide;tert-butyl N-[(2S)-1-[[2-[5-(furan-2-yl)-3-(trifluoromethyl)pyrazol-1-yl]-4-pyridinyl]methylamino]-1-oxopropan-2-yl]carbamate;tert-butyl N-[(2S)-1-[[2-[5-[(2-methoxyphenyl)methylcarbamoyl]-3-(trifluoromethyl)pyrazol-1-yl]-4-pyridinyl]methylamino]-1-oxopropan-2-yl]carbamate;(2-methoxyphenyl)methanamine;1-[4-[[[(2S)-2-[(2-methylpropan-2-yl)oxycarbonylamino]propanoyl]amino]methyl]-2-pyridinyl]-3-(trifluoromethyl)pyrazole-5-carboxylic acid
CID 157599042
2-[5-(Furan-2-yl)-4-methyl-3-phenylpyrazol-1-yl]-1,3-thiazole-4-carboxylic acid;2-[5-(furan-3-yl)-4-methyl-3-phenylpyrazol-1-yl]-1,3-thiazole-4-carboxylic acid;2-[5-(6-methoxy-3-pyridinyl)-4-methyl-3-phenylpyrazol-1-yl]-1,3-thiazole-4-carboxylic acid;2-[4-methyl-5-(1-methylpyrazol-4-yl)-3-phenylpyrazol-1-yl]-1,3-thiazole-4-carboxylic acid;2-(4-methyl-3-phenyl-5-pyridin-3-ylpyrazol-1-yl)-1,3-thiazole-4-carboxylic acid;2-[4-methyl-3-phenyl-5-(1,3,5-trimethylpyrazol-4-yl)pyrazol-1-yl]-1,3-thiazole-4-carboxylic acid
CID 162222867

Frequently Asked Questions

What is the IUPAC name of 1-[4-[[[(2S)-2-aminopropanoyl]amino]methyl]-1,3-thiazol-2-yl]-N-[(2-methoxyphenyl)methyl]-3-(trifluoromethyl)pyrazole-5-carboxamide;tert-butyl N-[(2S)-1-[[2-[5-(furan-2-yl)-3-(trifluoromethyl)pyrazol-1-yl]-1,3-thiazol-4-yl]methylamino]-1-oxopropan-2-yl]carbamate;tert-butyl N-[(2R)-1-[[2-[5-[(2-methoxyphenyl)methylcarbamoyl]-3-(trifluoromethyl)pyrazol-1-yl]-1,3-thiazol-4-yl]methylamino]-1-oxopropan-2-yl]carbamate;(2-methoxyphenyl)methanamine;1-[4-[[[(2S)-2-[(2-methylpropan-2-yl)oxycarbonylamino]propanoyl]amino]methyl]-1,3-thiazol-2-yl]-3-(trifluoromethyl)pyrazole-5-carboxylic acid?
The IUPAC name of 1-[4-[[[(2S)-2-aminopropanoyl]amino]methyl]-1,3-thiazol-2-yl]-N-[(2-methoxyphenyl)methyl]-3-(trifluoromethyl)pyrazole-5-carboxamide;tert-butyl N-[(2S)-1-[[2-[5-(furan-2-yl)-3-(trifluoromethyl)pyrazol-1-yl]-1,3-thiazol-4-yl]methylamino]-1-oxopropan-2-yl]carbamate;tert-butyl N-[(2R)-1-[[2-[5-[(2-methoxyphenyl)methylcarbamoyl]-3-(trifluoromethyl)pyrazol-1-yl]-1,3-thiazol-4-yl]methylamino]-1-oxopropan-2-yl]carbamate;(2-methoxyphenyl)methanamine;1-[4-[[[(2S)-2-[(2-methylpropan-2-yl)oxycarbonylamino]propanoyl]amino]methyl]-1,3-thiazol-2-yl]-3-(trifluoromethyl)pyrazole-5-carboxylic acid (CID 158123291) is 1-[4-[[[(2S)-2-aminopropanoyl]amino]methyl]-1,3-thiazol-2-yl]-N-[(2-methoxyphenyl)methyl]-3-(trifluoromethyl)pyrazole-5-carboxamide;tert-butyl N-[(2S)-1-[[2-[5-(furan-2-yl)-3-(trifluoromethyl)pyrazol-1-yl]-1,3-thiazol-4-yl]methylamino]-1-oxopropan-2-yl]carbamate;tert-butyl N-[(2R)-1-[[2-[5-[(2-methoxyphenyl)methylcarbamoyl]-3-(trifluoromethyl)pyrazol-1-yl]-1,3-thiazol-4-yl]methylamino]-1-oxopropan-2-yl]carbamate;(2-methoxyphenyl)methanamine;1-[4-[[[(2S)-2-[(2-methylpropan-2-yl)oxycarbonylamino]propanoyl]amino]methyl]-1,3-thiazol-2-yl]-3-(trifluoromethyl)pyrazole-5-carboxylic acid.
What is the SMILES notation for 1-[4-[[[(2S)-2-aminopropanoyl]amino]methyl]-1,3-thiazol-2-yl]-N-[(2-methoxyphenyl)methyl]-3-(trifluoromethyl)pyrazole-5-carboxamide;tert-butyl N-[(2S)-1-[[2-[5-(furan-2-yl)-3-(trifluoromethyl)pyrazol-1-yl]-1,3-thiazol-4-yl]methylamino]-1-oxopropan-2-yl]carbamate;tert-butyl N-[(2R)-1-[[2-[5-[(2-methoxyphenyl)methylcarbamoyl]-3-(trifluoromethyl)pyrazol-1-yl]-1,3-thiazol-4-yl]methylamino]-1-oxopropan-2-yl]carbamate;(2-methoxyphenyl)methanamine;1-[4-[[[(2S)-2-[(2-methylpropan-2-yl)oxycarbonylamino]propanoyl]amino]methyl]-1,3-thiazol-2-yl]-3-(trifluoromethyl)pyrazole-5-carboxylic acid?
The canonical SMILES for 1-[4-[[[(2S)-2-aminopropanoyl]amino]methyl]-1,3-thiazol-2-yl]-N-[(2-methoxyphenyl)methyl]-3-(trifluoromethyl)pyrazole-5-carboxamide;tert-butyl N-[(2S)-1-[[2-[5-(furan-2-yl)-3-(trifluoromethyl)pyrazol-1-yl]-1,3-thiazol-4-yl]methylamino]-1-oxopropan-2-yl]carbamate;tert-butyl N-[(2R)-1-[[2-[5-[(2-methoxyphenyl)methylcarbamoyl]-3-(trifluoromethyl)pyrazol-1-yl]-1,3-thiazol-4-yl]methylamino]-1-oxopropan-2-yl]carbamate;(2-methoxyphenyl)methanamine;1-[4-[[[(2S)-2-[(2-methylpropan-2-yl)oxycarbonylamino]propanoyl]amino]methyl]-1,3-thiazol-2-yl]-3-(trifluoromethyl)pyrazole-5-carboxylic acid is COc1ccccc1CN.COc1ccccc1CNC(=O)c1cc(C(F)(F)F)nn1-c1nc(CNC(=O)[C@@H](C)NC(=O)OC(C)(C)C)cs1.COc1ccccc1CNC(=O)c1cc(C(F)(F)F)nn1-c1nc(CNC(=O)[C@H](C)N)cs1.C[C@H](NC(=O)OC(C)(C)C)C(=O)NCc1csc(-n2nc(C(F)(F)F)cc2-c2ccco2)n1.C[C@H](NC(=O)OC(C)(C)C)C(=O)NCc1csc(-n2nc(C(F)(F)F)cc2C(=O)O)n1.
What is the InChIKey of 1-[4-[[[(2S)-2-aminopropanoyl]amino]methyl]-1,3-thiazol-2-yl]-N-[(2-methoxyphenyl)methyl]-3-(trifluoromethyl)pyrazole-5-carboxamide;tert-butyl N-[(2S)-1-[[2-[5-(furan-2-yl)-3-(trifluoromethyl)pyrazol-1-yl]-1,3-thiazol-4-yl]methylamino]-1-oxopropan-2-yl]carbamate;tert-butyl N-[(2R)-1-[[2-[5-[(2-methoxyphenyl)methylcarbamoyl]-3-(trifluoromethyl)pyrazol-1-yl]-1,3-thiazol-4-yl]methylamino]-1-oxopropan-2-yl]carbamate;(2-methoxyphenyl)methanamine;1-[4-[[[(2S)-2-[(2-methylpropan-2-yl)oxycarbonylamino]propanoyl]amino]methyl]-1,3-thiazol-2-yl]-3-(trifluoromethyl)pyrazole-5-carboxylic acid?
The InChIKey is FRVYXVYDTBECQM-WWXHBKQBSA-N. The full InChI is InChI=1S/C25H29F3N6O5S.C20H21F3N6O3S.C20H22F3N5O4S.C17H20F3N5O5S.C8H11NO/c1-14(31-23(37)39-24(2,3)4)20(35)30-12-16-13-40-22(32-16)34-17(10-19(33-34)25(26,27)28)21(36)29-11-15-8-6-7-9-18(15)38-5;1-11(24)17(30)26-9-13-10-33-19(27-13)29-14(7-16(28-29)20(21,22)23)18(31)25-8-12-5-3-4-6-15(12)32-2;1-11(25-18(30)32-19(2,3)4)16(29)24-9-12-10-33-17(26-12)28-13(14-6-5-7-31-14)8-15(27-28)20(21,22)23;1-8(22-15(29)30-16(2,3)4)12(26)21-6-9-7-31-14(23-9)25-10(13(27)28)5-11(24-25)17(18,19)20;1-10-8-5-3-2-4-7(8)6-9/h6-10,13-14H,11-12H2,1-5H3,(H,29,36)(H,30,35)(H,31,37);3-7,10-11H,8-9,24H2,1-2H3,(H,25,31)(H,26,30);5-8,10-11H,9H2,1-4H3,(H,24,29)(H,25,30);5,7-8H,6H2,1-4H3,(H,21,26)(H,22,29)(H,27,28);2-5H,6,9H2,1H3/t14-;2*11-;8-;/m1000./s1.
What are the key properties of 1-[4-[[[(2S)-2-aminopropanoyl]amino]methyl]-1,3-thiazol-2-yl]-N-[(2-methoxyphenyl)methyl]-3-(trifluoromethyl)pyrazole-5-carboxamide;tert-butyl N-[(2S)-1-[[2-[5-(furan-2-yl)-3-(trifluoromethyl)pyrazol-1-yl]-1,3-thiazol-4-yl]methylamino]-1-oxopropan-2-yl]carbamate;tert-butyl N-[(2R)-1-[[2-[5-[(2-methoxyphenyl)methylcarbamoyl]-3-(trifluoromethyl)pyrazol-1-yl]-1,3-thiazol-4-yl]methylamino]-1-oxopropan-2-yl]carbamate;(2-methoxyphenyl)methanamine;1-[4-[[[(2S)-2-[(2-methylpropan-2-yl)oxycarbonylamino]propanoyl]amino]methyl]-1,3-thiazol-2-yl]-3-(trifluoromethyl)pyrazole-5-carboxylic acid?
1-[4-[[[(2S)-2-aminopropanoyl]amino]methyl]-1,3-thiazol-2-yl]-N-[(2-methoxyphenyl)methyl]-3-(trifluoromethyl)pyrazole-5-carboxamide;tert-butyl N-[(2S)-1-[[2-[5-(furan-2-yl)-3-(trifluoromethyl)pyrazol-1-yl]-1,3-thiazol-4-yl]methylamino]-1-oxopropan-2-yl]carbamate;tert-butyl N-[(2R)-1-[[2-[5-[(2-methoxyphenyl)methylcarbamoyl]-3-(trifluoromethyl)pyrazol-1-yl]-1,3-thiazol-4-yl]methylamino]-1-oxopropan-2-yl]carbamate;(2-methoxyphenyl)methanamine;1-[4-[[[(2S)-2-[(2-methylpropan-2-yl)oxycarbonylamino]propanoyl]amino]methyl]-1,3-thiazol-2-yl]-3-(trifluoromethyl)pyrazole-5-carboxylic acid has a molecular weight of 2151.20 g/mol, XLogP of 13.93, 31 rotatable bonds, 12 hydrogen bond donors, and 35 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[4-[[[(2S)-2-aminopropanoyl]amino]methyl]-1,3-thiazol-2-yl]-N-[(2-methoxyphenyl)methyl]-3-(trifluoromethyl)pyrazole-5-carboxamide;tert-butyl N-[(2S)-1-[[2-[5-(furan-2-yl)-3-(trifluoromethyl)pyrazol-1-yl]-1,3-thiazol-4-yl]methylamino]-1-oxopropan-2-yl]carbamate;tert-butyl N-[(2R)-1-[[2-[5-[(2-methoxyphenyl)methylcarbamoyl]-3-(trifluoromethyl)pyrazol-1-yl]-1,3-thiazol-4-yl]methylamino]-1-oxopropan-2-yl]carbamate;(2-methoxyphenyl)methanamine;1-[4-[[[(2S)-2-[(2-methylpropan-2-yl)oxycarbonylamino]propanoyl]amino]methyl]-1,3-thiazol-2-yl]-3-(trifluoromethyl)pyrazole-5-carboxylic acid is sourced from PubChem (CID 158123291), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).