(1R,5S,7aS)-5-[2-[5-(4-acetyl-2-methylphenyl)-2-methoxy-3-pyridinyl]-5-(trifluoromethyl)phenyl]-1-[2-(trifluoromethyl)-4-pyridinyl]-1,2,5,6,7,7a-hexahydropyrrolo[1,2-c]imidazol-3-one;4-[3-[2-[(1R,5S,7aS)-1-[3-methyl-5-(trifluoromethyl)phenyl]-3-oxo-1,2,5,6,7,7a-hexahydropyrrolo[1,2-c]imidazol-5-yl]-4-(trifluoromethyl)phenyl]-4-methoxyphenyl]-3-methylbenzoic acid;3-[3-[2-[(1R,5S,7aS)-1-[3-methyl-5-(trifluoromethyl)phenyl]-3-oxo-1,2,5,6,7,7a-hexahydropyrrolo[1,2-c]imidazol-5-yl]-4-(trifluoromethyl)phenyl]-4-methoxyphenyl]propanoic acid

C101H86F18N8O11 — CID 157294774

IUPAC(1R,5S,7aS)-5-[2-[5-(4-acetyl-2-methylphenyl)-2-methoxy-3-pyridinyl]-5-(trifluoromethyl)phenyl]-1-[2-(trifluoromethyl)-4-pyridinyl]-1,2,5,6,7,7a-hexahydropyrrolo[1,2-c]imidazol-3-one;4-[3-[2-[(1R,5S,7aS)-1-[3-methyl-5-(trifluoromethyl)phenyl]-3-oxo-1,2,5,6,7,7a-hexahydropyrrolo[1,2-c]imidazol-5-yl]-4-(trifluoromethyl)phenyl]-4-methoxyphenyl]-3-methylbenzoic acid;3-[3-[2-[(1R,5S,7aS)-1-[3-methyl-5-(trifluoromethyl)phenyl]-3-oxo-1,2,5,6,7,7a-hexahydropyrrolo[1,2-c]imidazol-5-yl]-4-(trifluoromethyl)phenyl]-4-methoxyphenyl]propanoic acid
SMILESCOc1ccc(-c2ccc(C(=O)O)cc2C)cc1-c1ccc(C(F)(F)F)cc1[C@@H]1CC[C@H]2[C@@H](c3cc(C)cc(C(F)(F)F)c3)NC(=O)N12.COc1ccc(CCC(=O)O)cc1-c1ccc(C(F)(F)F)cc1[C@@H]1CC[C@H]2[C@@H](c3cc(C)cc(C(F)(F)F)c3)NC(=O)N12.COc1ncc(-c2ccc(C(C)=O)cc2C)cc1-c1ccc(C(F)(F)F)cc1[C@@H]1CC[C@H]2[C@@H](c3ccnc(C(F)(F)F)c3)NC(=O)N12
InChIInChI=1S/C36H30F6N2O4.C34H28F6N4O3.C31H28F6N2O4/c1-18-12-22(15-24(13-18)36(40,41)42)32-30-10-9-29(44(30)34(47)43-32)27-17-23(35(37,38)39)6-8-26(27)28-16-20(5-11-31(28)48-3)25-7-4-21(33(45)46)14-19(25)2;1-17-12-19(18(2)45)4-6-23(17)21-13-26(31(47-3)42-16-21)24-7-5-22(33(35,36)37)15-25(24)27-8-9-28-30(43-32(46)44(27)28)20-10-11-41-29(14-20)34(38,39)40;1-16-11-18(14-20(12-16)31(35,36)37)28-25-8-7-24(39(25)29(42)38-28)22-15-19(30(32,33)34)5-6-21(22)23-13-17(4-10-27(40)41)3-9-26(23)43-2/h4-8,11-17,29-30,32H,9-10H2,1-3H3,(H,43,47)(H,45,46);4-7,10-16,27-28,30H,8-9H2,1-3H3,(H,43,46);3,5-6,9,11-15,24-25,28H,4,7-8,10H2,1-2H3,(H,38,42)(H,40,41)/t29-,30-,32+;27-,28-,30+;24-,25-,28+/m000/s1
InChIKeyBBFKIXYXJUROJX-SEYVIOENSA-N
MW1929.81 g/mol
LogP25.39
Rot. Bonds19

About (1R,5S,7aS)-5-[2-[5-(4-acetyl-2-methylphenyl)-2-methoxy-3-pyridinyl]-5-(trifluoromethyl)phenyl]-1-[2-(trifluoromethyl)-4-pyridinyl]-1,2,5,6,7,7a-hexahydropyrrolo[1,2-c]imidazol-3-one;4-[3-[2-[(1R,5S,7aS)-1-[3-methyl-5-(trifluoromethyl)phenyl]-3-oxo-1,2,5,6,7,7a-hexahydropyrrolo[1,2-c]imidazol-5-yl]-4-(trifluoromethyl)phenyl]-4-methoxyphenyl]-3-methylbenzoic acid;3-[3-[2-[(1R,5S,7aS)-1-[3-methyl-5-(trifluoromethyl)phenyl]-3-oxo-1,2,5,6,7,7a-hexahydropyrrolo[1,2-c]imidazol-5-yl]-4-(trifluoromethyl)phenyl]-4-methoxyphenyl]propanoic acid

(1R,5S,7aS)-5-[2-[5-(4-acetyl-2-methylphenyl)-2-methoxy-3-pyridinyl]-5-(trifluoromethyl)phenyl]-1-[2-(trifluoromethyl)-4-pyridinyl]-1,2,5,6,7,7a-hexahydropyrrolo[1,2-c]imidazol-3-one;4-[3-[2-[(1R,5S,7aS)-1-[3-methyl-5-(trifluoromethyl)phenyl]-3-oxo-1,2,5,6,7,7a-hexahydropyrrolo[1,2-c]imidazol-5-yl]-4-(trifluoromethyl)phenyl]-4-methoxyphenyl]-3-methylbenzoic acid;3-[3-[2-[(1R,5S,7aS)-1-[3-methyl-5-(trifluoromethyl)phenyl]-3-oxo-1,2,5,6,7,7a-hexahydropyrrolo[1,2-c]imidazol-5-yl]-4-(trifluoromethyl)phenyl]-4-methoxyphenyl]propanoic acid (PubChem CID 157294774) has the molecular formula C101H86F18N8O11 and a molecular weight of 1929.81 g/mol. Its IUPAC name is (1R,5S,7aS)-5-[2-[5-(4-acetyl-2-methylphenyl)-2-methoxy-3-pyridinyl]-5-(trifluoromethyl)phenyl]-1-[2-(trifluoromethyl)-4-pyridinyl]-1,2,5,6,7,7a-hexahydropyrrolo[1,2-c]imidazol-3-one;4-[3-[2-[(1R,5S,7aS)-1-[3-methyl-5-(trifluoromethyl)phenyl]-3-oxo-1,2,5,6,7,7a-hexahydropyrrolo[1,2-c]imidazol-5-yl]-4-(trifluoromethyl)phenyl]-4-methoxyphenyl]-3-methylbenzoic acid;3-[3-[2-[(1R,5S,7aS)-1-[3-methyl-5-(trifluoromethyl)phenyl]-3-oxo-1,2,5,6,7,7a-hexahydropyrrolo[1,2-c]imidazol-5-yl]-4-(trifluoromethyl)phenyl]-4-methoxyphenyl]propanoic acid.

Molecular Properties

Compound Name(1R,5S,7aS)-5-[2-[5-(4-acetyl-2-methylphenyl)-2-methoxy-3-pyridinyl]-5-(trifluoromethyl)phenyl]-1-[2-(trifluoromethyl)-4-pyridinyl]-1,2,5,6,7,7a-hexahydropyrrolo[1,2-c]imidazol-3-one;4-[3-[2-[(1R,5S,7aS)-1-[3-methyl-5-(trifluoromethyl)phenyl]-3-oxo-1,2,5,6,7,7a-hexahydropyrrolo[1,2-c]imidazol-5-yl]-4-(trifluoromethyl)phenyl]-4-methoxyphenyl]-3-methylbenzoic acid;3-[3-[2-[(1R,5S,7aS)-1-[3-methyl-5-(trifluoromethyl)phenyl]-3-oxo-1,2,5,6,7,7a-hexahydropyrrolo[1,2-c]imidazol-5-yl]-4-(trifluoromethyl)phenyl]-4-methoxyphenyl]propanoic acid
PubChem CID157294774
Molecular FormulaC101H86F18N8O11
Molecular Weight1929.81 g/mol
Exact Mass1928.61
IUPAC Name(1R,5S,7aS)-5-[2-[5-(4-acetyl-2-methylphenyl)-2-methoxy-3-pyridinyl]-5-(trifluoromethyl)phenyl]-1-[2-(trifluoromethyl)-4-pyridinyl]-1,2,5,6,7,7a-hexahydropyrrolo[1,2-c]imidazol-3-one;4-[3-[2-[(1R,5S,7aS)-1-[3-methyl-5-(trifluoromethyl)phenyl]-3-oxo-1,2,5,6,7,7a-hexahydropyrrolo[1,2-c]imidazol-5-yl]-4-(trifluoromethyl)phenyl]-4-methoxyphenyl]-3-methylbenzoic acid;3-[3-[2-[(1R,5S,7aS)-1-[3-methyl-5-(trifluoromethyl)phenyl]-3-oxo-1,2,5,6,7,7a-hexahydropyrrolo[1,2-c]imidazol-5-yl]-4-(trifluoromethyl)phenyl]-4-methoxyphenyl]propanoic acid
SMILESCOc1ccc(-c2ccc(C(=O)O)cc2C)cc1-c1ccc(C(F)(F)F)cc1[C@@H]1CC[C@H]2[C@@H](c3cc(C)cc(C(F)(F)F)c3)NC(=O)N12.COc1ccc(CCC(=O)O)cc1-c1ccc(C(F)(F)F)cc1[C@@H]1CC[C@H]2[C@@H](c3cc(C)cc(C(F)(F)F)c3)NC(=O)N12.COc1ncc(-c2ccc(C(C)=O)cc2C)cc1-c1ccc(C(F)(F)F)cc1[C@@H]1CC[C@H]2[C@@H](c3ccnc(C(F)(F)F)c3)NC(=O)N12
InChIInChI=1S/C36H30F6N2O4.C34H28F6N4O3.C31H28F6N2O4/c1-18-12-22(15-24(13-18)36(40,41)42)32-30-10-9-29(44(30)34(47)43-32)27-17-23(35(37,38)39)6-8-26(27)28-16-20(5-11-31(28)48-3)25-7-4-21(33(45)46)14-19(25)2;1-17-12-19(18(2)45)4-6-23(17)21-13-26(31(47-3)42-16-21)24-7-5-22(33(35,36)37)15-25(24)27-8-9-28-30(43-32(46)44(27)28)20-10-11-41-29(14-20)34(38,39)40;1-16-11-18(14-20(12-16)31(35,36)37)28-25-8-7-24(39(25)29(42)38-28)22-15-19(30(32,33)34)5-6-21(22)23-13-17(4-10-27(40)41)3-9-26(23)43-2/h4-8,11-17,29-30,32H,9-10H2,1-3H3,(H,43,47)(H,45,46);4-7,10-16,27-28,30H,8-9H2,1-3H3,(H,43,46);3,5-6,9,11-15,24-25,28H,4,7-8,10H2,1-2H3,(H,38,42)(H,40,41)/t29-,30-,32+;27-,28-,30+;24-,25-,28+/m000/s1
InChIKeyBBFKIXYXJUROJX-SEYVIOENSA-N
XLogP25.39
TPSA242.16 Ų
H-Bond Donors5
H-Bond Acceptors11
Rotatable Bonds19
Heavy Atoms138
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5001929.81
LogP ≤ 525.39
H-Bond Donors ≤ 55
H-Bond Acceptors ≤ 1011

Analyze (1R,5S,7aS)-5-[2-[5-(4-acetyl-2-methylphenyl)-2-methoxy-3-pyridinyl]-5-(trifluoromethyl)phenyl]-1-[2-(trifluoromethyl)-4-pyridinyl]-1,2,5,6,7,7a-hexahydropyrrolo[1,2-c]imidazol-3-one;4-[3-[2-[(1R,5S,7aS)-1-[3-methyl-5-(trifluoromethyl)phenyl]-3-oxo-1,2,5,6,7,7a-hexahydropyrrolo[1,2-c]imidazol-5-yl]-4-(trifluoromethyl)phenyl]-4-methoxyphenyl]-3-methylbenzoic acid;3-[3-[2-[(1R,5S,7aS)-1-[3-methyl-5-(trifluoromethyl)phenyl]-3-oxo-1,2,5,6,7,7a-hexahydropyrrolo[1,2-c]imidazol-5-yl]-4-(trifluoromethyl)phenyl]-4-methoxyphenyl]propanoic acid with MolForge

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Related Compounds

4-[3-[4-[(1R,5S,7aS)-1-[3,5-bis(trifluoromethyl)phenyl]-3-oxo-1,2,5,6,7,7a-hexahydropyrrolo[1,2-c]imidazol-5-yl]-6-(trifluoromethyl)-3-pyridinyl]-4-methoxyphenyl]-3-methylbenzoic acid
CID 117850083
4-[5-[2-[(1R,5S,7aS)-1-[3,5-bis(trifluoromethyl)phenyl]-3-oxo-1,2,5,6,7,7a-hexahydropyrrolo[1,2-c]imidazol-5-yl]-4-(trifluoromethyl)phenyl]-6-methoxy-3-pyridinyl]-3,5-dimethylbenzoic acid
CID 117850097
4-(5-(2-((1R,5S,7aS)-1-(3,5-bis(trifluoromethyl)phenyl)-3-oxohexahydro-1H-pyrrolo[1,2-c]imidazol-5-yl)-4-(trifluoromethyl)phenyl)-6-methoxypyridin-3-yl)-3-methylbenzoic acid
CID 117850121
CID 117850275
CID 117850275
4-[5-[2-[[(4R,5S)-4-[3,5-bis(trifluoromethyl)phenyl]-5-methyl-2-oxoimidazolidin-1-yl]methyl]-6-(trifluoromethyl)-3-pyridinyl]-6-methoxy-3-pyridinyl]-3-methylbenzoic acid
CID 162674857
4-[5-[2-[(5S,7aS)-3-oxo-1-[2-(trifluoromethyl)-4-pyridinyl]-1,2,5,6,7,7a-hexahydropyrrolo[1,2-c]imidazol-5-yl]-4-(trifluoromethyl)phenyl]-6-methoxy-3-pyridinyl]-3-methylbenzoic acid
CID 117850078
4-[3-[2-[(1R,5S,7aS)-3-oxo-1-[2-(trifluoromethyl)pyridin-4-yl]-1,2,5,6,7,7a-hexahydropyrrolo[1,2-c]imidazol-5-yl]-4-(trifluoromethyl)phenyl]-4-methoxyphenyl]-3-methylbenzoic acid
CID 117850079
4-[3-[2-[(1R,5S,7aS)-1,7a-dimethyl-3-oxo-1-[2-(trifluoromethyl)-4-pyridinyl]-2,5,6,7-tetrahydropyrrolo[1,2-c]imidazol-5-yl]-4-(trifluoromethyl)phenyl]-4-methoxyphenyl]-3-methylbenzoic acid
CID 117850192
4-[5-[6-[(1R,5S,7aS)-3-oxo-1-[2-(trifluoromethyl)-4-pyridinyl]-1,2,5,6,7,7a-hexahydropyrrolo[1,2-c]imidazol-5-yl]-4-(trifluoromethyl)cyclohexa-1,3-dien-1-yl]-6-methoxy-3-pyridinyl]-3-methylbenzoic acid
CID 117850217
4-[5-[2-[(1R,5S,7aS)-3-oxo-1-[2-(trifluoromethyl)pyridin-4-yl]-1,2,5,6,7,7a-hexahydropyrrolo[1,2-c]imidazol-5-yl]-4-(trifluoromethyl)phenyl]-6-methoxypyridin-3-yl]-3-methylbenzoic acid
CID 121434608
(1R,5S,7aS)-5-[2-[5-(4-acetyl-2-methylphenyl)-2-methoxyphenyl]-5-(trifluoromethyl)phenyl]-1-[2-(trifluoromethyl)-4-pyridinyl]-1,2,5,6,7,7a-hexahydropyrrolo[1,2-c]imidazol-3-one
CID 121443152
(1R,5S,7aS)-5-[5-[5-(4-acetyl-2-methylphenyl)-2-methoxyphenyl]-2-(trifluoromethyl)-4-pyridinyl]-1-[3,5-bis(trifluoromethyl)phenyl]-1,2,5,6,7,7a-hexahydropyrrolo[1,2-c]imidazol-3-one
CID 121443155

Frequently Asked Questions

What is the IUPAC name of (1R,5S,7aS)-5-[2-[5-(4-acetyl-2-methylphenyl)-2-methoxy-3-pyridinyl]-5-(trifluoromethyl)phenyl]-1-[2-(trifluoromethyl)-4-pyridinyl]-1,2,5,6,7,7a-hexahydropyrrolo[1,2-c]imidazol-3-one;4-[3-[2-[(1R,5S,7aS)-1-[3-methyl-5-(trifluoromethyl)phenyl]-3-oxo-1,2,5,6,7,7a-hexahydropyrrolo[1,2-c]imidazol-5-yl]-4-(trifluoromethyl)phenyl]-4-methoxyphenyl]-3-methylbenzoic acid;3-[3-[2-[(1R,5S,7aS)-1-[3-methyl-5-(trifluoromethyl)phenyl]-3-oxo-1,2,5,6,7,7a-hexahydropyrrolo[1,2-c]imidazol-5-yl]-4-(trifluoromethyl)phenyl]-4-methoxyphenyl]propanoic acid?
The IUPAC name of (1R,5S,7aS)-5-[2-[5-(4-acetyl-2-methylphenyl)-2-methoxy-3-pyridinyl]-5-(trifluoromethyl)phenyl]-1-[2-(trifluoromethyl)-4-pyridinyl]-1,2,5,6,7,7a-hexahydropyrrolo[1,2-c]imidazol-3-one;4-[3-[2-[(1R,5S,7aS)-1-[3-methyl-5-(trifluoromethyl)phenyl]-3-oxo-1,2,5,6,7,7a-hexahydropyrrolo[1,2-c]imidazol-5-yl]-4-(trifluoromethyl)phenyl]-4-methoxyphenyl]-3-methylbenzoic acid;3-[3-[2-[(1R,5S,7aS)-1-[3-methyl-5-(trifluoromethyl)phenyl]-3-oxo-1,2,5,6,7,7a-hexahydropyrrolo[1,2-c]imidazol-5-yl]-4-(trifluoromethyl)phenyl]-4-methoxyphenyl]propanoic acid (CID 157294774) is (1R,5S,7aS)-5-[2-[5-(4-acetyl-2-methylphenyl)-2-methoxy-3-pyridinyl]-5-(trifluoromethyl)phenyl]-1-[2-(trifluoromethyl)-4-pyridinyl]-1,2,5,6,7,7a-hexahydropyrrolo[1,2-c]imidazol-3-one;4-[3-[2-[(1R,5S,7aS)-1-[3-methyl-5-(trifluoromethyl)phenyl]-3-oxo-1,2,5,6,7,7a-hexahydropyrrolo[1,2-c]imidazol-5-yl]-4-(trifluoromethyl)phenyl]-4-methoxyphenyl]-3-methylbenzoic acid;3-[3-[2-[(1R,5S,7aS)-1-[3-methyl-5-(trifluoromethyl)phenyl]-3-oxo-1,2,5,6,7,7a-hexahydropyrrolo[1,2-c]imidazol-5-yl]-4-(trifluoromethyl)phenyl]-4-methoxyphenyl]propanoic acid.
What is the SMILES notation for (1R,5S,7aS)-5-[2-[5-(4-acetyl-2-methylphenyl)-2-methoxy-3-pyridinyl]-5-(trifluoromethyl)phenyl]-1-[2-(trifluoromethyl)-4-pyridinyl]-1,2,5,6,7,7a-hexahydropyrrolo[1,2-c]imidazol-3-one;4-[3-[2-[(1R,5S,7aS)-1-[3-methyl-5-(trifluoromethyl)phenyl]-3-oxo-1,2,5,6,7,7a-hexahydropyrrolo[1,2-c]imidazol-5-yl]-4-(trifluoromethyl)phenyl]-4-methoxyphenyl]-3-methylbenzoic acid;3-[3-[2-[(1R,5S,7aS)-1-[3-methyl-5-(trifluoromethyl)phenyl]-3-oxo-1,2,5,6,7,7a-hexahydropyrrolo[1,2-c]imidazol-5-yl]-4-(trifluoromethyl)phenyl]-4-methoxyphenyl]propanoic acid?
The canonical SMILES for (1R,5S,7aS)-5-[2-[5-(4-acetyl-2-methylphenyl)-2-methoxy-3-pyridinyl]-5-(trifluoromethyl)phenyl]-1-[2-(trifluoromethyl)-4-pyridinyl]-1,2,5,6,7,7a-hexahydropyrrolo[1,2-c]imidazol-3-one;4-[3-[2-[(1R,5S,7aS)-1-[3-methyl-5-(trifluoromethyl)phenyl]-3-oxo-1,2,5,6,7,7a-hexahydropyrrolo[1,2-c]imidazol-5-yl]-4-(trifluoromethyl)phenyl]-4-methoxyphenyl]-3-methylbenzoic acid;3-[3-[2-[(1R,5S,7aS)-1-[3-methyl-5-(trifluoromethyl)phenyl]-3-oxo-1,2,5,6,7,7a-hexahydropyrrolo[1,2-c]imidazol-5-yl]-4-(trifluoromethyl)phenyl]-4-methoxyphenyl]propanoic acid is COc1ccc(-c2ccc(C(=O)O)cc2C)cc1-c1ccc(C(F)(F)F)cc1[C@@H]1CC[C@H]2[C@@H](c3cc(C)cc(C(F)(F)F)c3)NC(=O)N12.COc1ccc(CCC(=O)O)cc1-c1ccc(C(F)(F)F)cc1[C@@H]1CC[C@H]2[C@@H](c3cc(C)cc(C(F)(F)F)c3)NC(=O)N12.COc1ncc(-c2ccc(C(C)=O)cc2C)cc1-c1ccc(C(F)(F)F)cc1[C@@H]1CC[C@H]2[C@@H](c3ccnc(C(F)(F)F)c3)NC(=O)N12.
What is the InChIKey of (1R,5S,7aS)-5-[2-[5-(4-acetyl-2-methylphenyl)-2-methoxy-3-pyridinyl]-5-(trifluoromethyl)phenyl]-1-[2-(trifluoromethyl)-4-pyridinyl]-1,2,5,6,7,7a-hexahydropyrrolo[1,2-c]imidazol-3-one;4-[3-[2-[(1R,5S,7aS)-1-[3-methyl-5-(trifluoromethyl)phenyl]-3-oxo-1,2,5,6,7,7a-hexahydropyrrolo[1,2-c]imidazol-5-yl]-4-(trifluoromethyl)phenyl]-4-methoxyphenyl]-3-methylbenzoic acid;3-[3-[2-[(1R,5S,7aS)-1-[3-methyl-5-(trifluoromethyl)phenyl]-3-oxo-1,2,5,6,7,7a-hexahydropyrrolo[1,2-c]imidazol-5-yl]-4-(trifluoromethyl)phenyl]-4-methoxyphenyl]propanoic acid?
The InChIKey is BBFKIXYXJUROJX-SEYVIOENSA-N. The full InChI is InChI=1S/C36H30F6N2O4.C34H28F6N4O3.C31H28F6N2O4/c1-18-12-22(15-24(13-18)36(40,41)42)32-30-10-9-29(44(30)34(47)43-32)27-17-23(35(37,38)39)6-8-26(27)28-16-20(5-11-31(28)48-3)25-7-4-21(33(45)46)14-19(25)2;1-17-12-19(18(2)45)4-6-23(17)21-13-26(31(47-3)42-16-21)24-7-5-22(33(35,36)37)15-25(24)27-8-9-28-30(43-32(46)44(27)28)20-10-11-41-29(14-20)34(38,39)40;1-16-11-18(14-20(12-16)31(35,36)37)28-25-8-7-24(39(25)29(42)38-28)22-15-19(30(32,33)34)5-6-21(22)23-13-17(4-10-27(40)41)3-9-26(23)43-2/h4-8,11-17,29-30,32H,9-10H2,1-3H3,(H,43,47)(H,45,46);4-7,10-16,27-28,30H,8-9H2,1-3H3,(H,43,46);3,5-6,9,11-15,24-25,28H,4,7-8,10H2,1-2H3,(H,38,42)(H,40,41)/t29-,30-,32+;27-,28-,30+;24-,25-,28+/m000/s1.
What are the key properties of (1R,5S,7aS)-5-[2-[5-(4-acetyl-2-methylphenyl)-2-methoxy-3-pyridinyl]-5-(trifluoromethyl)phenyl]-1-[2-(trifluoromethyl)-4-pyridinyl]-1,2,5,6,7,7a-hexahydropyrrolo[1,2-c]imidazol-3-one;4-[3-[2-[(1R,5S,7aS)-1-[3-methyl-5-(trifluoromethyl)phenyl]-3-oxo-1,2,5,6,7,7a-hexahydropyrrolo[1,2-c]imidazol-5-yl]-4-(trifluoromethyl)phenyl]-4-methoxyphenyl]-3-methylbenzoic acid;3-[3-[2-[(1R,5S,7aS)-1-[3-methyl-5-(trifluoromethyl)phenyl]-3-oxo-1,2,5,6,7,7a-hexahydropyrrolo[1,2-c]imidazol-5-yl]-4-(trifluoromethyl)phenyl]-4-methoxyphenyl]propanoic acid?
(1R,5S,7aS)-5-[2-[5-(4-acetyl-2-methylphenyl)-2-methoxy-3-pyridinyl]-5-(trifluoromethyl)phenyl]-1-[2-(trifluoromethyl)-4-pyridinyl]-1,2,5,6,7,7a-hexahydropyrrolo[1,2-c]imidazol-3-one;4-[3-[2-[(1R,5S,7aS)-1-[3-methyl-5-(trifluoromethyl)phenyl]-3-oxo-1,2,5,6,7,7a-hexahydropyrrolo[1,2-c]imidazol-5-yl]-4-(trifluoromethyl)phenyl]-4-methoxyphenyl]-3-methylbenzoic acid;3-[3-[2-[(1R,5S,7aS)-1-[3-methyl-5-(trifluoromethyl)phenyl]-3-oxo-1,2,5,6,7,7a-hexahydropyrrolo[1,2-c]imidazol-5-yl]-4-(trifluoromethyl)phenyl]-4-methoxyphenyl]propanoic acid has a molecular weight of 1929.81 g/mol, XLogP of 25.39, 19 rotatable bonds, 5 hydrogen bond donors, and 11 hydrogen bond acceptors.
Where does this data come from?
All data for (1R,5S,7aS)-5-[2-[5-(4-acetyl-2-methylphenyl)-2-methoxy-3-pyridinyl]-5-(trifluoromethyl)phenyl]-1-[2-(trifluoromethyl)-4-pyridinyl]-1,2,5,6,7,7a-hexahydropyrrolo[1,2-c]imidazol-3-one;4-[3-[2-[(1R,5S,7aS)-1-[3-methyl-5-(trifluoromethyl)phenyl]-3-oxo-1,2,5,6,7,7a-hexahydropyrrolo[1,2-c]imidazol-5-yl]-4-(trifluoromethyl)phenyl]-4-methoxyphenyl]-3-methylbenzoic acid;3-[3-[2-[(1R,5S,7aS)-1-[3-methyl-5-(trifluoromethyl)phenyl]-3-oxo-1,2,5,6,7,7a-hexahydropyrrolo[1,2-c]imidazol-5-yl]-4-(trifluoromethyl)phenyl]-4-methoxyphenyl]propanoic acid is sourced from PubChem (CID 157294774), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).