(2S,3S,4R)-4-(3-chloro-7-methoxyquinoxalin-2-yl)oxy-3-ethylpyrrolidine-2-carboxylic acid;ditert-butyl (2S,3S,4R)-4-(3-chloro-7-methoxyquinoxalin-2-yl)oxy-3-ethylpyrrolidine-1,2-dicarboxylate;methyl (2S,3S,4R)-4-(3-chloro-7-methoxyquinoxalin-2-yl)oxy-1-[(2S)-3,3-dimethyl-2-[2-[(1R,2R)-1-methyl-2-pent-4-enylcyclopentyl]oxy-2-oxoethyl]butanoyl]-3-ethylpyrrolidine-2-carboxylate;methyl (2S,3S,4R)-4-(3-chloro-7-methoxyquinoxalin-2-yl)oxy-3-ethylpyrrolidine-2-carboxylate;2,2,2-trifluoroacetaldehyde

C96H123Cl4F3N12O22 — CID 158453562

IUPAC(2S,3S,4R)-4-(3-chloro-7-methoxyquinoxalin-2-yl)oxy-3-ethylpyrrolidine-2-carboxylic acid;ditert-butyl (2S,3S,4R)-4-(3-chloro-7-methoxyquinoxalin-2-yl)oxy-3-ethylpyrrolidine-1,2-dicarboxylate;methyl (2S,3S,4R)-4-(3-chloro-7-methoxyquinoxalin-2-yl)oxy-1-[(2S)-3,3-dimethyl-2-[2-[(1R,2R)-1-methyl-2-pent-4-enylcyclopentyl]oxy-2-oxoethyl]butanoyl]-3-ethylpyrrolidine-2-carboxylate;methyl (2S,3S,4R)-4-(3-chloro-7-methoxyquinoxalin-2-yl)oxy-3-ethylpyrrolidine-2-carboxylate;2,2,2-trifluoroacetaldehyde
SMILESC=CCCC[C@@H]1CCC[C@@]1(C)OC(=O)C[C@H](C(=O)N1C[C@H](Oc2nc3cc(OC)ccc3nc2Cl)[C@@H](CC)[C@H]1C(=O)OC)C(C)(C)C.CC[C@@H]1[C@@H](Oc2nc3cc(OC)ccc3nc2Cl)CN(C(=O)OC(C)(C)C)[C@@H]1C(=O)OC(C)(C)C.CC[C@@H]1[C@@H](Oc2nc3cc(OC)ccc3nc2Cl)CN[C@@H]1C(=O)O.CC[C@@H]1[C@@H](Oc2nc3cc(OC)ccc3nc2Cl)CN[C@@H]1C(=O)OC.O=CC(F)(F)F
InChIInChI=1S/C36H50ClN3O7.C25H34ClN3O6.C17H20ClN3O4.C16H18ClN3O4.C2HF3O/c1-9-11-12-14-22-15-13-18-36(22,6)47-29(41)20-25(35(3,4)5)33(42)40-21-28(24(10-2)30(40)34(43)45-8)46-32-31(37)38-26-17-16-23(44-7)19-27(26)39-32;1-9-15-18(33-21-20(26)27-16-11-10-14(32-8)12-17(16)28-21)13-29(23(31)35-25(5,6)7)19(15)22(30)34-24(2,3)4;1-4-10-13(8-19-14(10)17(22)24-3)25-16-15(18)20-11-6-5-9(23-2)7-12(11)21-16;1-3-9-12(7-18-13(9)16(21)22)24-15-14(17)19-10-5-4-8(23-2)6-11(10)20-15;3-2(4,5)1-6/h9,16-17,19,22,24-25,28,30H,1,10-15,18,20-21H2,2-8H3;10-12,15,18-19H,9,13H2,1-8H3;5-7,10,13-14,19H,4,8H2,1-3H3;4-6,9,12-13,18H,3,7H2,1-2H3,(H,21,22);1H/t22-,24-,25-,28+,30+,36-;15-,18+,19+;10-,13+,14+;9-,12+,13+;/m1111./s1
InChIKeyHEHHUTIHMZQIJE-ITUAIZDBSA-N
MW1995.91 g/mol
LogP17.07
Rot. Bonds28

About (2S,3S,4R)-4-(3-chloro-7-methoxyquinoxalin-2-yl)oxy-3-ethylpyrrolidine-2-carboxylic acid;ditert-butyl (2S,3S,4R)-4-(3-chloro-7-methoxyquinoxalin-2-yl)oxy-3-ethylpyrrolidine-1,2-dicarboxylate;methyl (2S,3S,4R)-4-(3-chloro-7-methoxyquinoxalin-2-yl)oxy-1-[(2S)-3,3-dimethyl-2-[2-[(1R,2R)-1-methyl-2-pent-4-enylcyclopentyl]oxy-2-oxoethyl]butanoyl]-3-ethylpyrrolidine-2-carboxylate;methyl (2S,3S,4R)-4-(3-chloro-7-methoxyquinoxalin-2-yl)oxy-3-ethylpyrrolidine-2-carboxylate;2,2,2-trifluoroacetaldehyde

(2S,3S,4R)-4-(3-chloro-7-methoxyquinoxalin-2-yl)oxy-3-ethylpyrrolidine-2-carboxylic acid;ditert-butyl (2S,3S,4R)-4-(3-chloro-7-methoxyquinoxalin-2-yl)oxy-3-ethylpyrrolidine-1,2-dicarboxylate;methyl (2S,3S,4R)-4-(3-chloro-7-methoxyquinoxalin-2-yl)oxy-1-[(2S)-3,3-dimethyl-2-[2-[(1R,2R)-1-methyl-2-pent-4-enylcyclopentyl]oxy-2-oxoethyl]butanoyl]-3-ethylpyrrolidine-2-carboxylate;methyl (2S,3S,4R)-4-(3-chloro-7-methoxyquinoxalin-2-yl)oxy-3-ethylpyrrolidine-2-carboxylate;2,2,2-trifluoroacetaldehyde (PubChem CID 158453562) has the molecular formula C96H123Cl4F3N12O22 and a molecular weight of 1995.91 g/mol. Its IUPAC name is (2S,3S,4R)-4-(3-chloro-7-methoxyquinoxalin-2-yl)oxy-3-ethylpyrrolidine-2-carboxylic acid;ditert-butyl (2S,3S,4R)-4-(3-chloro-7-methoxyquinoxalin-2-yl)oxy-3-ethylpyrrolidine-1,2-dicarboxylate;methyl (2S,3S,4R)-4-(3-chloro-7-methoxyquinoxalin-2-yl)oxy-1-[(2S)-3,3-dimethyl-2-[2-[(1R,2R)-1-methyl-2-pent-4-enylcyclopentyl]oxy-2-oxoethyl]butanoyl]-3-ethylpyrrolidine-2-carboxylate;methyl (2S,3S,4R)-4-(3-chloro-7-methoxyquinoxalin-2-yl)oxy-3-ethylpyrrolidine-2-carboxylate;2,2,2-trifluoroacetaldehyde.

Molecular Properties

Compound Name(2S,3S,4R)-4-(3-chloro-7-methoxyquinoxalin-2-yl)oxy-3-ethylpyrrolidine-2-carboxylic acid;ditert-butyl (2S,3S,4R)-4-(3-chloro-7-methoxyquinoxalin-2-yl)oxy-3-ethylpyrrolidine-1,2-dicarboxylate;methyl (2S,3S,4R)-4-(3-chloro-7-methoxyquinoxalin-2-yl)oxy-1-[(2S)-3,3-dimethyl-2-[2-[(1R,2R)-1-methyl-2-pent-4-enylcyclopentyl]oxy-2-oxoethyl]butanoyl]-3-ethylpyrrolidine-2-carboxylate;methyl (2S,3S,4R)-4-(3-chloro-7-methoxyquinoxalin-2-yl)oxy-3-ethylpyrrolidine-2-carboxylate;2,2,2-trifluoroacetaldehyde
PubChem CID158453562
Molecular FormulaC96H123Cl4F3N12O22
Molecular Weight1995.91 g/mol
Exact Mass1992.76
IUPAC Name(2S,3S,4R)-4-(3-chloro-7-methoxyquinoxalin-2-yl)oxy-3-ethylpyrrolidine-2-carboxylic acid;ditert-butyl (2S,3S,4R)-4-(3-chloro-7-methoxyquinoxalin-2-yl)oxy-3-ethylpyrrolidine-1,2-dicarboxylate;methyl (2S,3S,4R)-4-(3-chloro-7-methoxyquinoxalin-2-yl)oxy-1-[(2S)-3,3-dimethyl-2-[2-[(1R,2R)-1-methyl-2-pent-4-enylcyclopentyl]oxy-2-oxoethyl]butanoyl]-3-ethylpyrrolidine-2-carboxylate;methyl (2S,3S,4R)-4-(3-chloro-7-methoxyquinoxalin-2-yl)oxy-3-ethylpyrrolidine-2-carboxylate;2,2,2-trifluoroacetaldehyde
SMILESC=CCCC[C@@H]1CCC[C@@]1(C)OC(=O)C[C@H](C(=O)N1C[C@H](Oc2nc3cc(OC)ccc3nc2Cl)[C@@H](CC)[C@H]1C(=O)OC)C(C)(C)C.CC[C@@H]1[C@@H](Oc2nc3cc(OC)ccc3nc2Cl)CN(C(=O)OC(C)(C)C)[C@@H]1C(=O)OC(C)(C)C.CC[C@@H]1[C@@H](Oc2nc3cc(OC)ccc3nc2Cl)CN[C@@H]1C(=O)O.CC[C@@H]1[C@@H](Oc2nc3cc(OC)ccc3nc2Cl)CN[C@@H]1C(=O)OC.O=CC(F)(F)F
InChIInChI=1S/C36H50ClN3O7.C25H34ClN3O6.C17H20ClN3O4.C16H18ClN3O4.C2HF3O/c1-9-11-12-14-22-15-13-18-36(22,6)47-29(41)20-25(35(3,4)5)33(42)40-21-28(24(10-2)30(40)34(43)45-8)46-32-31(37)38-26-17-16-23(44-7)19-27(26)39-32;1-9-15-18(33-21-20(26)27-16-11-10-14(32-8)12-17(16)28-21)13-29(23(31)35-25(5,6)7)19(15)22(30)34-24(2,3)4;1-4-10-13(8-19-14(10)17(22)24-3)25-16-15(18)20-11-6-5-9(23-2)7-12(11)21-16;1-3-9-12(7-18-13(9)16(21)22)24-15-14(17)19-10-5-4-8(23-2)6-11(10)20-15;3-2(4,5)1-6/h9,16-17,19,22,24-25,28,30H,1,10-15,18,20-21H2,2-8H3;10-12,15,18-19H,9,13H2,1-8H3;5-7,10,13-14,19H,4,8H2,1-3H3;4-6,9,12-13,18H,3,7H2,1-2H3,(H,21,22);1H/t22-,24-,25-,28+,30+,36-;15-,18+,19+;10-,13+,14+;9-,12+,13+;/m1111./s1
InChIKeyHEHHUTIHMZQIJE-ITUAIZDBSA-N
XLogP17.07
TPSA410.44 Ų
H-Bond Donors3
H-Bond Acceptors31
Rotatable Bonds28
Heavy Atoms137
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5001995.91
LogP ≤ 517.07
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 1031

Computed Properties (RDKit)

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

Analyze (2S,3S,4R)-4-(3-chloro-7-methoxyquinoxalin-2-yl)oxy-3-ethylpyrrolidine-2-carboxylic acid;ditert-butyl (2S,3S,4R)-4-(3-chloro-7-methoxyquinoxalin-2-yl)oxy-3-ethylpyrrolidine-1,2-dicarboxylate;methyl (2S,3S,4R)-4-(3-chloro-7-methoxyquinoxalin-2-yl)oxy-1-[(2S)-3,3-dimethyl-2-[2-[(1R,2R)-1-methyl-2-pent-4-enylcyclopentyl]oxy-2-oxoethyl]butanoyl]-3-ethylpyrrolidine-2-carboxylate;methyl (2S,3S,4R)-4-(3-chloro-7-methoxyquinoxalin-2-yl)oxy-3-ethylpyrrolidine-2-carboxylate;2,2,2-trifluoroacetaldehyde with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

tert-butyl (2S,3S,4R)-4-(3-chloro-7-methoxyquinoxalin-2-yl)oxy-1-[(2S)-3,3-dimethyl-2-[2-oxo-2-[(1R,2R)-2-pent-4-enylcyclopentyl]oxyethyl]butanoyl]-3-ethylpyrrolidine-2-carboxylate;tert-butyl (2S,3S,4R)-4-(3-chloro-7-methoxyquinoxalin-2-yl)oxy-3-ethylpyrrolidine-2-carboxylate;tert-butyl (2S,3S,4R)-1-[(2S)-3,3-dimethyl-2-[2-oxo-2-[(1R,2R)-2-pent-4-enylcyclopentyl]oxyethyl]butanoyl]-4-(3-ethenyl-7-methoxyquinoxalin-2-yl)oxy-3-ethylpyrrolidine-2-carboxylate;methane;hydrochloride
CID 161128448
CID 158241912
CID 158241912
methyl 1-[3,3-dimethyl-2-[(1-methyl-2-pent-4-enylcyclopentyl)oxycarbonylamino]butanoyl]-4-(3-ethenyl-7-methoxyquinoxalin-2-yl)oxy-3-ethylpyrrolidine-2-carboxylate
CID 123942193
CID 158292790
CID 158292790
CID 158130793
CID 158130793
2-methylpropyl 4-(3-chloro-7-methoxyquinoxalin-2-yl)oxy-1-[3,3-dimethyl-2-[(1-methyl-2-pent-4-enylcyclopropyl)oxycarbonylamino]butanoyl]-3-ethylpyrrolidine-2-carboxylate
CID 123440393
CID 158895694
CID 158895694
CID 161229652
CID 161229652
tert-butyl (2S,3S,4R)-4-(3-chloro-7-methoxyquinoxalin-2-yl)oxy-1-[(2S)-3,3-dimethyl-2-[[(1R,2R)-2-pent-4-enylcyclopropyl]oxycarbonylamino]butanoyl]-3-(2-methylpropyl)pyrrolidine-2-carboxylate
CID 90058352
tert-butyl (2S,3S,4R)-4-(3-chloro-7-methoxyquinoxalin-2-yl)oxy-1-[(2S)-2-[[(1R,2R)-1-ethyl-2-pent-4-enylcyclopropyl]oxycarbonylamino]-3,3-dimethylbutanoyl]-3-methylpyrrolidine-2-carboxylate
CID 146047185
tert-butyl (2S,3S,4R)-4-(3-chloro-7-methoxyquinoxalin-2-yl)oxy-1-[(2S)-2-[[(1S,2S)-1-ethyl-2-pent-4-enylcyclopropyl]oxycarbonylamino]-3,3-dimethylbutanoyl]-3-methylpyrrolidine-2-carboxylate
CID 146047184
1-O-tert-butyl 2-O-methyl (2S,3S,4S)-4-[3-(1,1-difluorobut-3-enyl)-7-methoxyquinoxalin-2-yl]oxy-3-ethylpyrrolidine-1,2-dicarboxylate
CID 155885479

Frequently Asked Questions

What is the IUPAC name of (2S,3S,4R)-4-(3-chloro-7-methoxyquinoxalin-2-yl)oxy-3-ethylpyrrolidine-2-carboxylic acid;ditert-butyl (2S,3S,4R)-4-(3-chloro-7-methoxyquinoxalin-2-yl)oxy-3-ethylpyrrolidine-1,2-dicarboxylate;methyl (2S,3S,4R)-4-(3-chloro-7-methoxyquinoxalin-2-yl)oxy-1-[(2S)-3,3-dimethyl-2-[2-[(1R,2R)-1-methyl-2-pent-4-enylcyclopentyl]oxy-2-oxoethyl]butanoyl]-3-ethylpyrrolidine-2-carboxylate;methyl (2S,3S,4R)-4-(3-chloro-7-methoxyquinoxalin-2-yl)oxy-3-ethylpyrrolidine-2-carboxylate;2,2,2-trifluoroacetaldehyde?
The IUPAC name of (2S,3S,4R)-4-(3-chloro-7-methoxyquinoxalin-2-yl)oxy-3-ethylpyrrolidine-2-carboxylic acid;ditert-butyl (2S,3S,4R)-4-(3-chloro-7-methoxyquinoxalin-2-yl)oxy-3-ethylpyrrolidine-1,2-dicarboxylate;methyl (2S,3S,4R)-4-(3-chloro-7-methoxyquinoxalin-2-yl)oxy-1-[(2S)-3,3-dimethyl-2-[2-[(1R,2R)-1-methyl-2-pent-4-enylcyclopentyl]oxy-2-oxoethyl]butanoyl]-3-ethylpyrrolidine-2-carboxylate;methyl (2S,3S,4R)-4-(3-chloro-7-methoxyquinoxalin-2-yl)oxy-3-ethylpyrrolidine-2-carboxylate;2,2,2-trifluoroacetaldehyde (CID 158453562) is (2S,3S,4R)-4-(3-chloro-7-methoxyquinoxalin-2-yl)oxy-3-ethylpyrrolidine-2-carboxylic acid;ditert-butyl (2S,3S,4R)-4-(3-chloro-7-methoxyquinoxalin-2-yl)oxy-3-ethylpyrrolidine-1,2-dicarboxylate;methyl (2S,3S,4R)-4-(3-chloro-7-methoxyquinoxalin-2-yl)oxy-1-[(2S)-3,3-dimethyl-2-[2-[(1R,2R)-1-methyl-2-pent-4-enylcyclopentyl]oxy-2-oxoethyl]butanoyl]-3-ethylpyrrolidine-2-carboxylate;methyl (2S,3S,4R)-4-(3-chloro-7-methoxyquinoxalin-2-yl)oxy-3-ethylpyrrolidine-2-carboxylate;2,2,2-trifluoroacetaldehyde.
What is the SMILES notation for (2S,3S,4R)-4-(3-chloro-7-methoxyquinoxalin-2-yl)oxy-3-ethylpyrrolidine-2-carboxylic acid;ditert-butyl (2S,3S,4R)-4-(3-chloro-7-methoxyquinoxalin-2-yl)oxy-3-ethylpyrrolidine-1,2-dicarboxylate;methyl (2S,3S,4R)-4-(3-chloro-7-methoxyquinoxalin-2-yl)oxy-1-[(2S)-3,3-dimethyl-2-[2-[(1R,2R)-1-methyl-2-pent-4-enylcyclopentyl]oxy-2-oxoethyl]butanoyl]-3-ethylpyrrolidine-2-carboxylate;methyl (2S,3S,4R)-4-(3-chloro-7-methoxyquinoxalin-2-yl)oxy-3-ethylpyrrolidine-2-carboxylate;2,2,2-trifluoroacetaldehyde?
The canonical SMILES for (2S,3S,4R)-4-(3-chloro-7-methoxyquinoxalin-2-yl)oxy-3-ethylpyrrolidine-2-carboxylic acid;ditert-butyl (2S,3S,4R)-4-(3-chloro-7-methoxyquinoxalin-2-yl)oxy-3-ethylpyrrolidine-1,2-dicarboxylate;methyl (2S,3S,4R)-4-(3-chloro-7-methoxyquinoxalin-2-yl)oxy-1-[(2S)-3,3-dimethyl-2-[2-[(1R,2R)-1-methyl-2-pent-4-enylcyclopentyl]oxy-2-oxoethyl]butanoyl]-3-ethylpyrrolidine-2-carboxylate;methyl (2S,3S,4R)-4-(3-chloro-7-methoxyquinoxalin-2-yl)oxy-3-ethylpyrrolidine-2-carboxylate;2,2,2-trifluoroacetaldehyde is C=CCCC[C@@H]1CCC[C@@]1(C)OC(=O)C[C@H](C(=O)N1C[C@H](Oc2nc3cc(OC)ccc3nc2Cl)[C@@H](CC)[C@H]1C(=O)OC)C(C)(C)C.CC[C@@H]1[C@@H](Oc2nc3cc(OC)ccc3nc2Cl)CN(C(=O)OC(C)(C)C)[C@@H]1C(=O)OC(C)(C)C.CC[C@@H]1[C@@H](Oc2nc3cc(OC)ccc3nc2Cl)CN[C@@H]1C(=O)O.CC[C@@H]1[C@@H](Oc2nc3cc(OC)ccc3nc2Cl)CN[C@@H]1C(=O)OC.O=CC(F)(F)F.
What is the InChIKey of (2S,3S,4R)-4-(3-chloro-7-methoxyquinoxalin-2-yl)oxy-3-ethylpyrrolidine-2-carboxylic acid;ditert-butyl (2S,3S,4R)-4-(3-chloro-7-methoxyquinoxalin-2-yl)oxy-3-ethylpyrrolidine-1,2-dicarboxylate;methyl (2S,3S,4R)-4-(3-chloro-7-methoxyquinoxalin-2-yl)oxy-1-[(2S)-3,3-dimethyl-2-[2-[(1R,2R)-1-methyl-2-pent-4-enylcyclopentyl]oxy-2-oxoethyl]butanoyl]-3-ethylpyrrolidine-2-carboxylate;methyl (2S,3S,4R)-4-(3-chloro-7-methoxyquinoxalin-2-yl)oxy-3-ethylpyrrolidine-2-carboxylate;2,2,2-trifluoroacetaldehyde?
The InChIKey is HEHHUTIHMZQIJE-ITUAIZDBSA-N. The full InChI is InChI=1S/C36H50ClN3O7.C25H34ClN3O6.C17H20ClN3O4.C16H18ClN3O4.C2HF3O/c1-9-11-12-14-22-15-13-18-36(22,6)47-29(41)20-25(35(3,4)5)33(42)40-21-28(24(10-2)30(40)34(43)45-8)46-32-31(37)38-26-17-16-23(44-7)19-27(26)39-32;1-9-15-18(33-21-20(26)27-16-11-10-14(32-8)12-17(16)28-21)13-29(23(31)35-25(5,6)7)19(15)22(30)34-24(2,3)4;1-4-10-13(8-19-14(10)17(22)24-3)25-16-15(18)20-11-6-5-9(23-2)7-12(11)21-16;1-3-9-12(7-18-13(9)16(21)22)24-15-14(17)19-10-5-4-8(23-2)6-11(10)20-15;3-2(4,5)1-6/h9,16-17,19,22,24-25,28,30H,1,10-15,18,20-21H2,2-8H3;10-12,15,18-19H,9,13H2,1-8H3;5-7,10,13-14,19H,4,8H2,1-3H3;4-6,9,12-13,18H,3,7H2,1-2H3,(H,21,22);1H/t22-,24-,25-,28+,30+,36-;15-,18+,19+;10-,13+,14+;9-,12+,13+;/m1111./s1.
What are the key properties of (2S,3S,4R)-4-(3-chloro-7-methoxyquinoxalin-2-yl)oxy-3-ethylpyrrolidine-2-carboxylic acid;ditert-butyl (2S,3S,4R)-4-(3-chloro-7-methoxyquinoxalin-2-yl)oxy-3-ethylpyrrolidine-1,2-dicarboxylate;methyl (2S,3S,4R)-4-(3-chloro-7-methoxyquinoxalin-2-yl)oxy-1-[(2S)-3,3-dimethyl-2-[2-[(1R,2R)-1-methyl-2-pent-4-enylcyclopentyl]oxy-2-oxoethyl]butanoyl]-3-ethylpyrrolidine-2-carboxylate;methyl (2S,3S,4R)-4-(3-chloro-7-methoxyquinoxalin-2-yl)oxy-3-ethylpyrrolidine-2-carboxylate;2,2,2-trifluoroacetaldehyde?
(2S,3S,4R)-4-(3-chloro-7-methoxyquinoxalin-2-yl)oxy-3-ethylpyrrolidine-2-carboxylic acid;ditert-butyl (2S,3S,4R)-4-(3-chloro-7-methoxyquinoxalin-2-yl)oxy-3-ethylpyrrolidine-1,2-dicarboxylate;methyl (2S,3S,4R)-4-(3-chloro-7-methoxyquinoxalin-2-yl)oxy-1-[(2S)-3,3-dimethyl-2-[2-[(1R,2R)-1-methyl-2-pent-4-enylcyclopentyl]oxy-2-oxoethyl]butanoyl]-3-ethylpyrrolidine-2-carboxylate;methyl (2S,3S,4R)-4-(3-chloro-7-methoxyquinoxalin-2-yl)oxy-3-ethylpyrrolidine-2-carboxylate;2,2,2-trifluoroacetaldehyde has a molecular weight of 1995.91 g/mol, XLogP of 17.07, 28 rotatable bonds, 3 hydrogen bond donors, and 31 hydrogen bond acceptors.
Where does this data come from?
All data for (2S,3S,4R)-4-(3-chloro-7-methoxyquinoxalin-2-yl)oxy-3-ethylpyrrolidine-2-carboxylic acid;ditert-butyl (2S,3S,4R)-4-(3-chloro-7-methoxyquinoxalin-2-yl)oxy-3-ethylpyrrolidine-1,2-dicarboxylate;methyl (2S,3S,4R)-4-(3-chloro-7-methoxyquinoxalin-2-yl)oxy-1-[(2S)-3,3-dimethyl-2-[2-[(1R,2R)-1-methyl-2-pent-4-enylcyclopentyl]oxy-2-oxoethyl]butanoyl]-3-ethylpyrrolidine-2-carboxylate;methyl (2S,3S,4R)-4-(3-chloro-7-methoxyquinoxalin-2-yl)oxy-3-ethylpyrrolidine-2-carboxylate;2,2,2-trifluoroacetaldehyde is sourced from PubChem (CID 158453562), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).