[1-[2-[[3-(4-chlorophenoxy)phenyl]methyl]-1,3,3a,4,6,6a-hexahydropyrrolo[3,4-c]pyrrole-5-carbonyl]pyrazol-4-yl]-morpholin-4-ylmethanone;1-[1-[2-[[5-chloro-2-(trifluoromethyl)phenyl]methyl]-1,3,3a,4,6,6a-hexahydropyrrolo[3,4-c]pyrrole-5-carbonyl]pyrazol-4-yl]ethanone;1-[1-[(5S)-7-[[3-chloro-5-(trifluoromethyl)phenyl]methyl]-2,7-diazaspiro[4.4]nonane-2-carbonyl]pyrazol-4-yl]ethanone;1-[1-[2-[(3-methyl-5-pyrrolidin-1-ylphenyl)methyl]-1,3,3a,4,6,6a-hexahydropyrrolo[3,4-c]pyrrole-5-carbonyl]pyrazol-4-yl]ethanone;1-[1-[(5R)-7-[[4-morpholin-4-yl-2-(trifluoromethyl)phenyl]methyl]-2,7-diazaspiro[4.4]nonane-2-carbonyl]pyrazol-4-yl]ethanone;1-[1-[(5S)-7-[[4-morpholin-4-yl-2-(trifluoromethyl)phenyl]methyl]-2,7-diazaspiro[4.4]nonane-2-carbonyl]pyrazol-4-yl]ethanone;1-[1-[2-[[4-pyrrolidin-1-yl-2-(trifluoromethyl)phenyl]methyl]-1,3,3a,4,6,6a-hexahydropyrrolo[3,4-c]pyrrole-5-carbonyl]pyrazol-4-yl]ethanone

C167H191Cl3F15N33O18 — CID 159545323

About [1-[2-[[3-(4-chlorophenoxy)phenyl]methyl]-1,3,3a,4,6,6a-hexahydropyrrolo[3,4-c]pyrrole-5-carbonyl]pyrazol-4-yl]-morpholin-4-ylmethanone;1-[1-[2-[[5-chloro-2-(trifluoromethyl)phenyl]methyl]-1,3,3a,4,6,6a-hexahydropyrrolo[3,4-c]pyrrole-5-carbonyl]pyrazol-4-yl]ethanone;1-[1-[(5S)-7-[[3-chloro-5-(trifluoromethyl)phenyl]methyl]-2,7-diazaspiro[4.4]nonane-2-carbonyl]pyrazol-4-yl]ethanone;1-[1-[2-[(3-methyl-5-pyrrolidin-1-ylphenyl)methyl]-1,3,3a,4,6,6a-hexahydropyrrolo[3,4-c]pyrrole-5-carbonyl]pyrazol-4-yl]ethanone;1-[1-[(5R)-7-[[4-morpholin-4-yl-2-(trifluoromethyl)phenyl]methyl]-2,7-diazaspiro[4.4]nonane-2-carbonyl]pyrazol-4-yl]ethanone;1-[1-[(5S)-7-[[4-morpholin-4-yl-2-(trifluoromethyl)phenyl]methyl]-2,7-diazaspiro[4.4]nonane-2-carbonyl]pyrazol-4-yl]ethanone;1-[1-[2-[[4-pyrrolidin-1-yl-2-(trifluoromethyl)phenyl]methyl]-1,3,3a,4,6,6a-hexahydropyrrolo[3,4-c]pyrrole-5-carbonyl]pyrazol-4-yl]ethanone

[1-[2-[[3-(4-chlorophenoxy)phenyl]methyl]-1,3,3a,4,6,6a-hexahydropyrrolo[3,4-c]pyrrole-5-carbonyl]pyrazol-4-yl]-morpholin-4-ylmethanone;1-[1-[2-[[5-chloro-2-(trifluoromethyl)phenyl]methyl]-1,3,3a,4,6,6a-hexahydropyrrolo[3,4-c]pyrrole-5-carbonyl]pyrazol-4-yl]ethanone;1-[1-[(5S)-7-[[3-chloro-5-(trifluoromethyl)phenyl]methyl]-2,7-diazaspiro[4.4]nonane-2-carbonyl]pyrazol-4-yl]ethanone;1-[1-[2-[(3-methyl-5-pyrrolidin-1-ylphenyl)methyl]-1,3,3a,4,6,6a-hexahydropyrrolo[3,4-c]pyrrole-5-carbonyl]pyrazol-4-yl]ethanone;1-[1-[(5R)-7-[[4-morpholin-4-yl-2-(trifluoromethyl)phenyl]methyl]-2,7-diazaspiro[4.4]nonane-2-carbonyl]pyrazol-4-yl]ethanone;1-[1-[(5S)-7-[[4-morpholin-4-yl-2-(trifluoromethyl)phenyl]methyl]-2,7-diazaspiro[4.4]nonane-2-carbonyl]pyrazol-4-yl]ethanone;1-[1-[2-[[4-pyrrolidin-1-yl-2-(trifluoromethyl)phenyl]methyl]-1,3,3a,4,6,6a-hexahydropyrrolo[3,4-c]pyrrole-5-carbonyl]pyrazol-4-yl]ethanone (PubChem CID 159545323) has the molecular formula C167H191Cl3F15N33O18 and a molecular weight of 3339.91 g/mol. Its IUPAC name is [1-[2-[[3-(4-chlorophenoxy)phenyl]methyl]-1,3,3a,4,6,6a-hexahydropyrrolo[3,4-c]pyrrole-5-carbonyl]pyrazol-4-yl]-morpholin-4-ylmethanone;1-[1-[2-[[5-chloro-2-(trifluoromethyl)phenyl]methyl]-1,3,3a,4,6,6a-hexahydropyrrolo[3,4-c]pyrrole-5-carbonyl]pyrazol-4-yl]ethanone;1-[1-[(5S)-7-[[3-chloro-5-(trifluoromethyl)phenyl]methyl]-2,7-diazaspiro[4.4]nonane-2-carbonyl]pyrazol-4-yl]ethanone;1-[1-[2-[(3-methyl-5-pyrrolidin-1-ylphenyl)methyl]-1,3,3a,4,6,6a-hexahydropyrrolo[3,4-c]pyrrole-5-carbonyl]pyrazol-4-yl]ethanone;1-[1-[(5R)-7-[[4-morpholin-4-yl-2-(trifluoromethyl)phenyl]methyl]-2,7-diazaspiro[4.4]nonane-2-carbonyl]pyrazol-4-yl]ethanone;1-[1-[(5S)-7-[[4-morpholin-4-yl-2-(trifluoromethyl)phenyl]methyl]-2,7-diazaspiro[4.4]nonane-2-carbonyl]pyrazol-4-yl]ethanone;1-[1-[2-[[4-pyrrolidin-1-yl-2-(trifluoromethyl)phenyl]methyl]-1,3,3a,4,6,6a-hexahydropyrrolo[3,4-c]pyrrole-5-carbonyl]pyrazol-4-yl]ethanone.

Molecular Properties

• Compound Name: [1-[2-[[3-(4-chlorophenoxy)phenyl]methyl]-1,3,3a,4,6,6a-hexahydropyrrolo[3,4-c]pyrrole-5-carbonyl]pyrazol-4-yl]-morpholin-4-ylmethanone;1-[1-[2-[[5-chloro-2-(trifluoromethyl)phenyl]methyl]-1,3,3a,4,6,6a-hexahydropyrrolo[3,4-c]pyrrole-5-carbonyl]pyrazol-4-yl]ethanone;1-[1-[(5S)-7-[[3-chloro-5-(trifluoromethyl)phenyl]methyl]-2,7-diazaspiro[4.4]nonane-2-carbonyl]pyrazol-4-yl]ethanone;1-[1-[2-[(3-methyl-5-pyrrolidin-1-ylphenyl)methyl]-1,3,3a,4,6,6a-hexahydropyrrolo[3,4-c]pyrrole-5-carbonyl]pyrazol-4-yl]ethanone;1-[1-[(5R)-7-[[4-morpholin-4-yl-2-(trifluoromethyl)phenyl]methyl]-2,7-diazaspiro[4.4]nonane-2-carbonyl]pyrazol-4-yl]ethanone;1-[1-[(5S)-7-[[4-morpholin-4-yl-2-(trifluoromethyl)phenyl]methyl]-2,7-diazaspiro[4.4]nonane-2-carbonyl]pyrazol-4-yl]ethanone;1-[1-[2-[[4-pyrrolidin-1-yl-2-(trifluoromethyl)phenyl]methyl]-1,3,3a,4,6,6a-hexahydropyrrolo[3,4-c]pyrrole-5-carbonyl]pyrazol-4-yl]ethanone
• PubChem CID: 159545323
• Molecular Formula: C167H191Cl3F15N33O18
• Molecular Weight: 3339.91 g/mol
• Exact Mass: 3336.39
• IUPAC Name: [1-[2-[[3-(4-chlorophenoxy)phenyl]methyl]-1,3,3a,4,6,6a-hexahydropyrrolo[3,4-c]pyrrole-5-carbonyl]pyrazol-4-yl]-morpholin-4-ylmethanone;1-[1-[2-[[5-chloro-2-(trifluoromethyl)phenyl]methyl]-1,3,3a,4,6,6a-hexahydropyrrolo[3,4-c]pyrrole-5-carbonyl]pyrazol-4-yl]ethanone;1-[1-[(5S)-7-[[3-chloro-5-(trifluoromethyl)phenyl]methyl]-2,7-diazaspiro[4.4]nonane-2-carbonyl]pyrazol-4-yl]ethanone;1-[1-[2-[(3-methyl-5-pyrrolidin-1-ylphenyl)methyl]-1,3,3a,4,6,6a-hexahydropyrrolo[3,4-c]pyrrole-5-carbonyl]pyrazol-4-yl]ethanone;1-[1-[(5R)-7-[[4-morpholin-4-yl-2-(trifluoromethyl)phenyl]methyl]-2,7-diazaspiro[4.4]nonane-2-carbonyl]pyrazol-4-yl]ethanone;1-[1-[(5S)-7-[[4-morpholin-4-yl-2-(trifluoromethyl)phenyl]methyl]-2,7-diazaspiro[4.4]nonane-2-carbonyl]pyrazol-4-yl]ethanone;1-[1-[2-[[4-pyrrolidin-1-yl-2-(trifluoromethyl)phenyl]methyl]-1,3,3a,4,6,6a-hexahydropyrrolo[3,4-c]pyrrole-5-carbonyl]pyrazol-4-yl]ethanone
• SMILES: CC(=O)c1cnn(C(=O)N2CC3CN(Cc4cc(C)cc(N5CCCC5)c4)CC3C2)c1.CC(=O)c1cnn(C(=O)N2CC3CN(Cc4cc(Cl)ccc4C(F)(F)F)CC3C2)c1.CC(=O)c1cnn(C(=O)N2CC3CN(Cc4ccc(N5CCCC5)cc4C(F)(F)F)CC3C2)c1.CC(=O)c1cnn(C(=O)N2CC[C@@]3(CCN(Cc4ccc(N5CCOCC5)cc4C(F)(F)F)C3)C2)c1.CC(=O)c1cnn(C(=O)N2CC[C@]3(CCN(Cc4cc(Cl)cc(C(F)(F)F)c4)C3)C2)c1.CC(=O)c1cnn(C(=O)N2CC[C@]3(CCN(Cc4ccc(N5CCOCC5)cc4C(F)(F)F)C3)C2)c1.O=C(c1cnn(C(=O)N2CC3CN(Cc4cccc(Oc5ccc(Cl)cc5)c4)CC3C2)c1)N1CCOCC1
• InChI: InChI=1S/C28H30ClN5O4.2C25H30F3N5O3.C24H28F3N5O2.C24H31N5O2.C21H22ClF3N4O2.C20H20ClF3N4O2/c29-24-4-6-25(7-5-24)38-26-3-1-2-20(12-26)14-31-15-22-17-33(18-23(22)16-31)28(36)34-19-21(13-30-34)27(35)32-8-10-37-11-9-32;2*1-18(34)20-13-29-33(15-20)23(35)32-7-5-24(17-32)4-6-30(16-24)14-19-2-3-21(12-22(19)25(26,27)28)31-8-10-36-11-9-31;1-16(33)18-9-28-32(15-18)23(34)31-13-19-11-29(12-20(19)14-31)10-17-4-5-21(30-6-2-3-7-30)8-22(17)24(25,26)27;1-17-7-19(9-23(8-17)27-5-3-4-6-27)11-26-12-21-14-28(15-22(21)13-26)24(31)29-16-20(10-25-29)18(2)30;1-14(30)16-9-26-29(11-16)19(31)28-5-3-20(13-28)2-4-27(12-20)10-15-6-17(21(23,24)25)8-18(22)7-15;1-12(29)14-5-25-28(11-14)19(30)27-9-15-7-26(8-16(15)10-27)6-13-4-17(21)2-3-18(13)20(22,23)24/h1-7,12-13,19,22-23H,8-11,14-18H2;2*2-3,12-13,15H,4-11,14,16-17H2,1H3;4-5,8-9,15,19-20H,2-3,6-7,10-14H2,1H3;7-10,16,21-22H,3-6,11-15H2,1-2H3;6-9,11H,2-5,10,12-13H2,1H3;2-5,11,15-16H,6-10H2,1H3/t;2*24-;;;20-;/m.10..0./s1
• InChIKey: MESPAVAEQUBYHY-MRKYSLJWSA-N
• XLogP: 25.72
• TPSA: 462.20 Ų
• H-Bond Acceptors: 43
• Rotatable Bonds: 27
• Heavy Atoms: 236
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	3339.91
LogP ≤ 5	25.72
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	43

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'anil_di_alk_D(198)', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of [1-[2-[[3-(4-chlorophenoxy)phenyl]methyl]-1,3,3a,4,6,6a-hexahydropyrrolo[3,4-c]pyrrole-5-carbonyl]pyrazol-4-yl]-morpholin-4-ylmethanone;1-[1-[2-[[5-chloro-2-(trifluoromethyl)phenyl]methyl]-1,3,3a,4,6,6a-hexahydropyrrolo[3,4-c]pyrrole-5-carbonyl]pyrazol-4-yl]ethanone;1-[1-[(5S)-7-[[3-chloro-5-(trifluoromethyl)phenyl]methyl]-2,7-diazaspiro[4.4]nonane-2-carbonyl]pyrazol-4-yl]ethanone;1-[1-[2-[(3-methyl-5-pyrrolidin-1-ylphenyl)methyl]-1,3,3a,4,6,6a-hexahydropyrrolo[3,4-c]pyrrole-5-carbonyl]pyrazol-4-yl]ethanone;1-[1-[(5R)-7-[[4-morpholin-4-yl-2-(trifluoromethyl)phenyl]methyl]-2,7-diazaspiro[4.4]nonane-2-carbonyl]pyrazol-4-yl]ethanone;1-[1-[(5S)-7-[[4-morpholin-4-yl-2-(trifluoromethyl)phenyl]methyl]-2,7-diazaspiro[4.4]nonane-2-carbonyl]pyrazol-4-yl]ethanone;1-[1-[2-[[4-pyrrolidin-1-yl-2-(trifluoromethyl)phenyl]methyl]-1,3,3a,4,6,6a-hexahydropyrrolo[3,4-c]pyrrole-5-carbonyl]pyrazol-4-yl]ethanone?

The IUPAC name of [1-[2-[[3-(4-chlorophenoxy)phenyl]methyl]-1,3,3a,4,6,6a-hexahydropyrrolo[3,4-c]pyrrole-5-carbonyl]pyrazol-4-yl]-morpholin-4-ylmethanone;1-[1-[2-[[5-chloro-2-(trifluoromethyl)phenyl]methyl]-1,3,3a,4,6,6a-hexahydropyrrolo[3,4-c]pyrrole-5-carbonyl]pyrazol-4-yl]ethanone;1-[1-[(5S)-7-[[3-chloro-5-(trifluoromethyl)phenyl]methyl]-2,7-diazaspiro[4.4]nonane-2-carbonyl]pyrazol-4-yl]ethanone;1-[1-[2-[(3-methyl-5-pyrrolidin-1-ylphenyl)methyl]-1,3,3a,4,6,6a-hexahydropyrrolo[3,4-c]pyrrole-5-carbonyl]pyrazol-4-yl]ethanone;1-[1-[(5R)-7-[[4-morpholin-4-yl-2-(trifluoromethyl)phenyl]methyl]-2,7-diazaspiro[4.4]nonane-2-carbonyl]pyrazol-4-yl]ethanone;1-[1-[(5S)-7-[[4-morpholin-4-yl-2-(trifluoromethyl)phenyl]methyl]-2,7-diazaspiro[4.4]nonane-2-carbonyl]pyrazol-4-yl]ethanone;1-[1-[2-[[4-pyrrolidin-1-yl-2-(trifluoromethyl)phenyl]methyl]-1,3,3a,4,6,6a-hexahydropyrrolo[3,4-c]pyrrole-5-carbonyl]pyrazol-4-yl]ethanone (CID 159545323) is [1-[2-[[3-(4-chlorophenoxy)phenyl]methyl]-1,3,3a,4,6,6a-hexahydropyrrolo[3,4-c]pyrrole-5-carbonyl]pyrazol-4-yl]-morpholin-4-ylmethanone;1-[1-[2-[[5-chloro-2-(trifluoromethyl)phenyl]methyl]-1,3,3a,4,6,6a-hexahydropyrrolo[3,4-c]pyrrole-5-carbonyl]pyrazol-4-yl]ethanone;1-[1-[(5S)-7-[[3-chloro-5-(trifluoromethyl)phenyl]methyl]-2,7-diazaspiro[4.4]nonane-2-carbonyl]pyrazol-4-yl]ethanone;1-[1-[2-[(3-methyl-5-pyrrolidin-1-ylphenyl)methyl]-1,3,3a,4,6,6a-hexahydropyrrolo[3,4-c]pyrrole-5-carbonyl]pyrazol-4-yl]ethanone;1-[1-[(5R)-7-[[4-morpholin-4-yl-2-(trifluoromethyl)phenyl]methyl]-2,7-diazaspiro[4.4]nonane-2-carbonyl]pyrazol-4-yl]ethanone;1-[1-[(5S)-7-[[4-morpholin-4-yl-2-(trifluoromethyl)phenyl]methyl]-2,7-diazaspiro[4.4]nonane-2-carbonyl]pyrazol-4-yl]ethanone;1-[1-[2-[[4-pyrrolidin-1-yl-2-(trifluoromethyl)phenyl]methyl]-1,3,3a,4,6,6a-hexahydropyrrolo[3,4-c]pyrrole-5-carbonyl]pyrazol-4-yl]ethanone.

What is the SMILES notation for [1-[2-[[3-(4-chlorophenoxy)phenyl]methyl]-1,3,3a,4,6,6a-hexahydropyrrolo[3,4-c]pyrrole-5-carbonyl]pyrazol-4-yl]-morpholin-4-ylmethanone;1-[1-[2-[[5-chloro-2-(trifluoromethyl)phenyl]methyl]-1,3,3a,4,6,6a-hexahydropyrrolo[3,4-c]pyrrole-5-carbonyl]pyrazol-4-yl]ethanone;1-[1-[(5S)-7-[[3-chloro-5-(trifluoromethyl)phenyl]methyl]-2,7-diazaspiro[4.4]nonane-2-carbonyl]pyrazol-4-yl]ethanone;1-[1-[2-[(3-methyl-5-pyrrolidin-1-ylphenyl)methyl]-1,3,3a,4,6,6a-hexahydropyrrolo[3,4-c]pyrrole-5-carbonyl]pyrazol-4-yl]ethanone;1-[1-[(5R)-7-[[4-morpholin-4-yl-2-(trifluoromethyl)phenyl]methyl]-2,7-diazaspiro[4.4]nonane-2-carbonyl]pyrazol-4-yl]ethanone;1-[1-[(5S)-7-[[4-morpholin-4-yl-2-(trifluoromethyl)phenyl]methyl]-2,7-diazaspiro[4.4]nonane-2-carbonyl]pyrazol-4-yl]ethanone;1-[1-[2-[[4-pyrrolidin-1-yl-2-(trifluoromethyl)phenyl]methyl]-1,3,3a,4,6,6a-hexahydropyrrolo[3,4-c]pyrrole-5-carbonyl]pyrazol-4-yl]ethanone?

The canonical SMILES for [1-[2-[[3-(4-chlorophenoxy)phenyl]methyl]-1,3,3a,4,6,6a-hexahydropyrrolo[3,4-c]pyrrole-5-carbonyl]pyrazol-4-yl]-morpholin-4-ylmethanone;1-[1-[2-[[5-chloro-2-(trifluoromethyl)phenyl]methyl]-1,3,3a,4,6,6a-hexahydropyrrolo[3,4-c]pyrrole-5-carbonyl]pyrazol-4-yl]ethanone;1-[1-[(5S)-7-[[3-chloro-5-(trifluoromethyl)phenyl]methyl]-2,7-diazaspiro[4.4]nonane-2-carbonyl]pyrazol-4-yl]ethanone;1-[1-[2-[(3-methyl-5-pyrrolidin-1-ylphenyl)methyl]-1,3,3a,4,6,6a-hexahydropyrrolo[3,4-c]pyrrole-5-carbonyl]pyrazol-4-yl]ethanone;1-[1-[(5R)-7-[[4-morpholin-4-yl-2-(trifluoromethyl)phenyl]methyl]-2,7-diazaspiro[4.4]nonane-2-carbonyl]pyrazol-4-yl]ethanone;1-[1-[(5S)-7-[[4-morpholin-4-yl-2-(trifluoromethyl)phenyl]methyl]-2,7-diazaspiro[4.4]nonane-2-carbonyl]pyrazol-4-yl]ethanone;1-[1-[2-[[4-pyrrolidin-1-yl-2-(trifluoromethyl)phenyl]methyl]-1,3,3a,4,6,6a-hexahydropyrrolo[3,4-c]pyrrole-5-carbonyl]pyrazol-4-yl]ethanone is CC(=O)c1cnn(C(=O)N2CC3CN(Cc4cc(C)cc(N5CCCC5)c4)CC3C2)c1.CC(=O)c1cnn(C(=O)N2CC3CN(Cc4cc(Cl)ccc4C(F)(F)F)CC3C2)c1.CC(=O)c1cnn(C(=O)N2CC3CN(Cc4ccc(N5CCCC5)cc4C(F)(F)F)CC3C2)c1.CC(=O)c1cnn(C(=O)N2CC[C@@]3(CCN(Cc4ccc(N5CCOCC5)cc4C(F)(F)F)C3)C2)c1.CC(=O)c1cnn(C(=O)N2CC[C@]3(CCN(Cc4cc(Cl)cc(C(F)(F)F)c4)C3)C2)c1.CC(=O)c1cnn(C(=O)N2CC[C@]3(CCN(Cc4ccc(N5CCOCC5)cc4C(F)(F)F)C3)C2)c1.O=C(c1cnn(C(=O)N2CC3CN(Cc4cccc(Oc5ccc(Cl)cc5)c4)CC3C2)c1)N1CCOCC1.

What is the InChIKey of [1-[2-[[3-(4-chlorophenoxy)phenyl]methyl]-1,3,3a,4,6,6a-hexahydropyrrolo[3,4-c]pyrrole-5-carbonyl]pyrazol-4-yl]-morpholin-4-ylmethanone;1-[1-[2-[[5-chloro-2-(trifluoromethyl)phenyl]methyl]-1,3,3a,4,6,6a-hexahydropyrrolo[3,4-c]pyrrole-5-carbonyl]pyrazol-4-yl]ethanone;1-[1-[(5S)-7-[[3-chloro-5-(trifluoromethyl)phenyl]methyl]-2,7-diazaspiro[4.4]nonane-2-carbonyl]pyrazol-4-yl]ethanone;1-[1-[2-[(3-methyl-5-pyrrolidin-1-ylphenyl)methyl]-1,3,3a,4,6,6a-hexahydropyrrolo[3,4-c]pyrrole-5-carbonyl]pyrazol-4-yl]ethanone;1-[1-[(5R)-7-[[4-morpholin-4-yl-2-(trifluoromethyl)phenyl]methyl]-2,7-diazaspiro[4.4]nonane-2-carbonyl]pyrazol-4-yl]ethanone;1-[1-[(5S)-7-[[4-morpholin-4-yl-2-(trifluoromethyl)phenyl]methyl]-2,7-diazaspiro[4.4]nonane-2-carbonyl]pyrazol-4-yl]ethanone;1-[1-[2-[[4-pyrrolidin-1-yl-2-(trifluoromethyl)phenyl]methyl]-1,3,3a,4,6,6a-hexahydropyrrolo[3,4-c]pyrrole-5-carbonyl]pyrazol-4-yl]ethanone?

The InChIKey is MESPAVAEQUBYHY-MRKYSLJWSA-N. The full InChI is InChI=1S/C28H30ClN5O4.2C25H30F3N5O3.C24H28F3N5O2.C24H31N5O2.C21H22ClF3N4O2.C20H20ClF3N4O2/c29-24-4-6-25(7-5-24)38-26-3-1-2-20(12-26)14-31-15-22-17-33(18-23(22)16-31)28(36)34-19-21(13-30-34)27(35)32-8-10-37-11-9-32;2*1-18(34)20-13-29-33(15-20)23(35)32-7-5-24(17-32)4-6-30(16-24)14-19-2-3-21(12-22(19)25(26,27)28)31-8-10-36-11-9-31;1-16(33)18-9-28-32(15-18)23(34)31-13-19-11-29(12-20(19)14-31)10-17-4-5-21(30-6-2-3-7-30)8-22(17)24(25,26)27;1-17-7-19(9-23(8-17)27-5-3-4-6-27)11-26-12-21-14-28(15-22(21)13-26)24(31)29-16-20(10-25-29)18(2)30;1-14(30)16-9-26-29(11-16)19(31)28-5-3-20(13-28)2-4-27(12-20)10-15-6-17(21(23,24)25)8-18(22)7-15;1-12(29)14-5-25-28(11-14)19(30)27-9-15-7-26(8-16(15)10-27)6-13-4-17(21)2-3-18(13)20(22,23)24/h1-7,12-13,19,22-23H,8-11,14-18H2;2*2-3,12-13,15H,4-11,14,16-17H2,1H3;4-5,8-9,15,19-20H,2-3,6-7,10-14H2,1H3;7-10,16,21-22H,3-6,11-15H2,1-2H3;6-9,11H,2-5,10,12-13H2,1H3;2-5,11,15-16H,6-10H2,1H3/t;2*24-;;;20-;/m.10..0./s1.

What are the key properties of [1-[2-[[3-(4-chlorophenoxy)phenyl]methyl]-1,3,3a,4,6,6a-hexahydropyrrolo[3,4-c]pyrrole-5-carbonyl]pyrazol-4-yl]-morpholin-4-ylmethanone;1-[1-[2-[[5-chloro-2-(trifluoromethyl)phenyl]methyl]-1,3,3a,4,6,6a-hexahydropyrrolo[3,4-c]pyrrole-5-carbonyl]pyrazol-4-yl]ethanone;1-[1-[(5S)-7-[[3-chloro-5-(trifluoromethyl)phenyl]methyl]-2,7-diazaspiro[4.4]nonane-2-carbonyl]pyrazol-4-yl]ethanone;1-[1-[2-[(3-methyl-5-pyrrolidin-1-ylphenyl)methyl]-1,3,3a,4,6,6a-hexahydropyrrolo[3,4-c]pyrrole-5-carbonyl]pyrazol-4-yl]ethanone;1-[1-[(5R)-7-[[4-morpholin-4-yl-2-(trifluoromethyl)phenyl]methyl]-2,7-diazaspiro[4.4]nonane-2-carbonyl]pyrazol-4-yl]ethanone;1-[1-[(5S)-7-[[4-morpholin-4-yl-2-(trifluoromethyl)phenyl]methyl]-2,7-diazaspiro[4.4]nonane-2-carbonyl]pyrazol-4-yl]ethanone;1-[1-[2-[[4-pyrrolidin-1-yl-2-(trifluoromethyl)phenyl]methyl]-1,3,3a,4,6,6a-hexahydropyrrolo[3,4-c]pyrrole-5-carbonyl]pyrazol-4-yl]ethanone?

[1-[2-[[3-(4-chlorophenoxy)phenyl]methyl]-1,3,3a,4,6,6a-hexahydropyrrolo[3,4-c]pyrrole-5-carbonyl]pyrazol-4-yl]-morpholin-4-ylmethanone;1-[1-[2-[[5-chloro-2-(trifluoromethyl)phenyl]methyl]-1,3,3a,4,6,6a-hexahydropyrrolo[3,4-c]pyrrole-5-carbonyl]pyrazol-4-yl]ethanone;1-[1-[(5S)-7-[[3-chloro-5-(trifluoromethyl)phenyl]methyl]-2,7-diazaspiro[4.4]nonane-2-carbonyl]pyrazol-4-yl]ethanone;1-[1-[2-[(3-methyl-5-pyrrolidin-1-ylphenyl)methyl]-1,3,3a,4,6,6a-hexahydropyrrolo[3,4-c]pyrrole-5-carbonyl]pyrazol-4-yl]ethanone;1-[1-[(5R)-7-[[4-morpholin-4-yl-2-(trifluoromethyl)phenyl]methyl]-2,7-diazaspiro[4.4]nonane-2-carbonyl]pyrazol-4-yl]ethanone;1-[1-[(5S)-7-[[4-morpholin-4-yl-2-(trifluoromethyl)phenyl]methyl]-2,7-diazaspiro[4.4]nonane-2-carbonyl]pyrazol-4-yl]ethanone;1-[1-[2-[[4-pyrrolidin-1-yl-2-(trifluoromethyl)phenyl]methyl]-1,3,3a,4,6,6a-hexahydropyrrolo[3,4-c]pyrrole-5-carbonyl]pyrazol-4-yl]ethanone has a molecular weight of 3339.91 g/mol, XLogP of 25.72, 27 rotatable bonds, 0 hydrogen bond donors, and 43 hydrogen bond acceptors.

Where does this data come from?

All data for [1-[2-[[3-(4-chlorophenoxy)phenyl]methyl]-1,3,3a,4,6,6a-hexahydropyrrolo[3,4-c]pyrrole-5-carbonyl]pyrazol-4-yl]-morpholin-4-ylmethanone;1-[1-[2-[[5-chloro-2-(trifluoromethyl)phenyl]methyl]-1,3,3a,4,6,6a-hexahydropyrrolo[3,4-c]pyrrole-5-carbonyl]pyrazol-4-yl]ethanone;1-[1-[(5S)-7-[[3-chloro-5-(trifluoromethyl)phenyl]methyl]-2,7-diazaspiro[4.4]nonane-2-carbonyl]pyrazol-4-yl]ethanone;1-[1-[2-[(3-methyl-5-pyrrolidin-1-ylphenyl)methyl]-1,3,3a,4,6,6a-hexahydropyrrolo[3,4-c]pyrrole-5-carbonyl]pyrazol-4-yl]ethanone;1-[1-[(5R)-7-[[4-morpholin-4-yl-2-(trifluoromethyl)phenyl]methyl]-2,7-diazaspiro[4.4]nonane-2-carbonyl]pyrazol-4-yl]ethanone;1-[1-[(5S)-7-[[4-morpholin-4-yl-2-(trifluoromethyl)phenyl]methyl]-2,7-diazaspiro[4.4]nonane-2-carbonyl]pyrazol-4-yl]ethanone;1-[1-[2-[[4-pyrrolidin-1-yl-2-(trifluoromethyl)phenyl]methyl]-1,3,3a,4,6,6a-hexahydropyrrolo[3,4-c]pyrrole-5-carbonyl]pyrazol-4-yl]ethanone is sourced from PubChem (CID 159545323), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).