(2S)-2-(4-chlorophenyl)-2-hydroxy-N-[4-[7-(1-methylpyrazol-4-yl)pyrrolo[1,2-a]pyrazin-1-yl]phenyl]propanamide;(2R)-2-(4-chlorophenyl)-2-hydroxy-N-[4-[7-(1-methylpyrazol-4-yl)pyrrolo[1,2-a]pyrazin-1-yl]phenyl]propanamide;2-(4-chlorophenyl)-2-hydroxy-N-[4-[7-(1-methylpyrazol-4-yl)pyrrolo[1,2-a]pyrazin-1-yl]phenyl]propanamide;(2S)-2-(4-chlorophenyl)-2-methoxy-N-[4-[7-(1-methylpyrazol-4-yl)pyrrolo[1,2-a]pyrazin-1-yl]phenyl]acetamide;2-(4-chlorophenyl)-2-methoxy-N-[4-[7-(1-methylpyrazol-4-yl)pyrrolo[1,2-a]pyrazin-1-yl]phenyl]acetamide

C130H110Cl5N25O10 — CID 158070338

IUPAC(2S)-2-(4-chlorophenyl)-2-hydroxy-N-[4-[7-(1-methylpyrazol-4-yl)pyrrolo[1,2-a]pyrazin-1-yl]phenyl]propanamide;(2R)-2-(4-chlorophenyl)-2-hydroxy-N-[4-[7-(1-methylpyrazol-4-yl)pyrrolo[1,2-a]pyrazin-1-yl]phenyl]propanamide;2-(4-chlorophenyl)-2-hydroxy-N-[4-[7-(1-methylpyrazol-4-yl)pyrrolo[1,2-a]pyrazin-1-yl]phenyl]propanamide;(2S)-2-(4-chlorophenyl)-2-methoxy-N-[4-[7-(1-methylpyrazol-4-yl)pyrrolo[1,2-a]pyrazin-1-yl]phenyl]acetamide;2-(4-chlorophenyl)-2-methoxy-N-[4-[7-(1-methylpyrazol-4-yl)pyrrolo[1,2-a]pyrazin-1-yl]phenyl]acetamide
SMILESCOC(C(=O)Nc1ccc(-c2nccn3cc(-c4cnn(C)c4)cc23)cc1)c1ccc(Cl)cc1.CO[C@H](C(=O)Nc1ccc(-c2nccn3cc(-c4cnn(C)c4)cc23)cc1)c1ccc(Cl)cc1.Cn1cc(-c2cc3c(-c4ccc(NC(=O)C(C)(O)c5ccc(Cl)cc5)cc4)nccn3c2)cn1.Cn1cc(-c2cc3c(-c4ccc(NC(=O)[C@@](C)(O)c5ccc(Cl)cc5)cc4)nccn3c2)cn1.Cn1cc(-c2cc3c(-c4ccc(NC(=O)[C@](C)(O)c5ccc(Cl)cc5)cc4)nccn3c2)cn1
InChIInChI=1S/5C26H22ClN5O2/c3*1-26(34,20-5-7-21(27)8-6-20)25(33)30-22-9-3-17(4-10-22)24-23-13-18(16-32(23)12-11-28-24)19-14-29-31(2)15-19;2*1-31-15-20(14-29-31)19-13-23-24(28-11-12-32(23)16-19)17-5-9-22(10-6-17)30-26(33)25(34-2)18-3-7-21(27)8-4-18/h3*3-16,34H,1-2H3,(H,30,33);2*3-16,25H,1-2H3,(H,30,33)/t2*26-;;25-;/m10.0./s1
InChIKeyFLTAYJLJWNTDRG-XMSSIGKUSA-N
MW2359.74 g/mol
LogP25.47
Rot. Bonds27

About (2S)-2-(4-chlorophenyl)-2-hydroxy-N-[4-[7-(1-methylpyrazol-4-yl)pyrrolo[1,2-a]pyrazin-1-yl]phenyl]propanamide;(2R)-2-(4-chlorophenyl)-2-hydroxy-N-[4-[7-(1-methylpyrazol-4-yl)pyrrolo[1,2-a]pyrazin-1-yl]phenyl]propanamide;2-(4-chlorophenyl)-2-hydroxy-N-[4-[7-(1-methylpyrazol-4-yl)pyrrolo[1,2-a]pyrazin-1-yl]phenyl]propanamide;(2S)-2-(4-chlorophenyl)-2-methoxy-N-[4-[7-(1-methylpyrazol-4-yl)pyrrolo[1,2-a]pyrazin-1-yl]phenyl]acetamide;2-(4-chlorophenyl)-2-methoxy-N-[4-[7-(1-methylpyrazol-4-yl)pyrrolo[1,2-a]pyrazin-1-yl]phenyl]acetamide

(2S)-2-(4-chlorophenyl)-2-hydroxy-N-[4-[7-(1-methylpyrazol-4-yl)pyrrolo[1,2-a]pyrazin-1-yl]phenyl]propanamide;(2R)-2-(4-chlorophenyl)-2-hydroxy-N-[4-[7-(1-methylpyrazol-4-yl)pyrrolo[1,2-a]pyrazin-1-yl]phenyl]propanamide;2-(4-chlorophenyl)-2-hydroxy-N-[4-[7-(1-methylpyrazol-4-yl)pyrrolo[1,2-a]pyrazin-1-yl]phenyl]propanamide;(2S)-2-(4-chlorophenyl)-2-methoxy-N-[4-[7-(1-methylpyrazol-4-yl)pyrrolo[1,2-a]pyrazin-1-yl]phenyl]acetamide;2-(4-chlorophenyl)-2-methoxy-N-[4-[7-(1-methylpyrazol-4-yl)pyrrolo[1,2-a]pyrazin-1-yl]phenyl]acetamide (PubChem CID 158070338) has the molecular formula C130H110Cl5N25O10 and a molecular weight of 2359.74 g/mol. Its IUPAC name is (2S)-2-(4-chlorophenyl)-2-hydroxy-N-[4-[7-(1-methylpyrazol-4-yl)pyrrolo[1,2-a]pyrazin-1-yl]phenyl]propanamide;(2R)-2-(4-chlorophenyl)-2-hydroxy-N-[4-[7-(1-methylpyrazol-4-yl)pyrrolo[1,2-a]pyrazin-1-yl]phenyl]propanamide;2-(4-chlorophenyl)-2-hydroxy-N-[4-[7-(1-methylpyrazol-4-yl)pyrrolo[1,2-a]pyrazin-1-yl]phenyl]propanamide;(2S)-2-(4-chlorophenyl)-2-methoxy-N-[4-[7-(1-methylpyrazol-4-yl)pyrrolo[1,2-a]pyrazin-1-yl]phenyl]acetamide;2-(4-chlorophenyl)-2-methoxy-N-[4-[7-(1-methylpyrazol-4-yl)pyrrolo[1,2-a]pyrazin-1-yl]phenyl]acetamide.

Molecular Properties

Compound Name(2S)-2-(4-chlorophenyl)-2-hydroxy-N-[4-[7-(1-methylpyrazol-4-yl)pyrrolo[1,2-a]pyrazin-1-yl]phenyl]propanamide;(2R)-2-(4-chlorophenyl)-2-hydroxy-N-[4-[7-(1-methylpyrazol-4-yl)pyrrolo[1,2-a]pyrazin-1-yl]phenyl]propanamide;2-(4-chlorophenyl)-2-hydroxy-N-[4-[7-(1-methylpyrazol-4-yl)pyrrolo[1,2-a]pyrazin-1-yl]phenyl]propanamide;(2S)-2-(4-chlorophenyl)-2-methoxy-N-[4-[7-(1-methylpyrazol-4-yl)pyrrolo[1,2-a]pyrazin-1-yl]phenyl]acetamide;2-(4-chlorophenyl)-2-methoxy-N-[4-[7-(1-methylpyrazol-4-yl)pyrrolo[1,2-a]pyrazin-1-yl]phenyl]acetamide
PubChem CID158070338
Molecular FormulaC130H110Cl5N25O10
Molecular Weight2359.74 g/mol
Exact Mass2355.73
IUPAC Name(2S)-2-(4-chlorophenyl)-2-hydroxy-N-[4-[7-(1-methylpyrazol-4-yl)pyrrolo[1,2-a]pyrazin-1-yl]phenyl]propanamide;(2R)-2-(4-chlorophenyl)-2-hydroxy-N-[4-[7-(1-methylpyrazol-4-yl)pyrrolo[1,2-a]pyrazin-1-yl]phenyl]propanamide;2-(4-chlorophenyl)-2-hydroxy-N-[4-[7-(1-methylpyrazol-4-yl)pyrrolo[1,2-a]pyrazin-1-yl]phenyl]propanamide;(2S)-2-(4-chlorophenyl)-2-methoxy-N-[4-[7-(1-methylpyrazol-4-yl)pyrrolo[1,2-a]pyrazin-1-yl]phenyl]acetamide;2-(4-chlorophenyl)-2-methoxy-N-[4-[7-(1-methylpyrazol-4-yl)pyrrolo[1,2-a]pyrazin-1-yl]phenyl]acetamide
SMILESCOC(C(=O)Nc1ccc(-c2nccn3cc(-c4cnn(C)c4)cc23)cc1)c1ccc(Cl)cc1.CO[C@H](C(=O)Nc1ccc(-c2nccn3cc(-c4cnn(C)c4)cc23)cc1)c1ccc(Cl)cc1.Cn1cc(-c2cc3c(-c4ccc(NC(=O)C(C)(O)c5ccc(Cl)cc5)cc4)nccn3c2)cn1.Cn1cc(-c2cc3c(-c4ccc(NC(=O)[C@@](C)(O)c5ccc(Cl)cc5)cc4)nccn3c2)cn1.Cn1cc(-c2cc3c(-c4ccc(NC(=O)[C@](C)(O)c5ccc(Cl)cc5)cc4)nccn3c2)cn1
InChIInChI=1S/5C26H22ClN5O2/c3*1-26(34,20-5-7-21(27)8-6-20)25(33)30-22-9-3-17(4-10-22)24-23-13-18(16-32(23)12-11-28-24)19-14-29-31(2)15-19;2*1-31-15-20(14-29-31)19-13-23-24(28-11-12-32(23)16-19)17-5-9-22(10-6-17)30-26(33)25(34-2)18-3-7-21(27)8-4-18/h3*3-16,34H,1-2H3,(H,30,33);2*3-16,25H,1-2H3,(H,30,33)/t2*26-;;25-;/m10.0./s1
InChIKeyFLTAYJLJWNTDRG-XMSSIGKUSA-N
XLogP25.47
TPSA400.25 Ų
H-Bond Donors8
H-Bond Acceptors30
Rotatable Bonds27
Heavy Atoms170
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5002359.74
LogP ≤ 525.47
H-Bond Donors ≤ 58
H-Bond Acceptors ≤ 1030

Analyze (2S)-2-(4-chlorophenyl)-2-hydroxy-N-[4-[7-(1-methylpyrazol-4-yl)pyrrolo[1,2-a]pyrazin-1-yl]phenyl]propanamide;(2R)-2-(4-chlorophenyl)-2-hydroxy-N-[4-[7-(1-methylpyrazol-4-yl)pyrrolo[1,2-a]pyrazin-1-yl]phenyl]propanamide;2-(4-chlorophenyl)-2-hydroxy-N-[4-[7-(1-methylpyrazol-4-yl)pyrrolo[1,2-a]pyrazin-1-yl]phenyl]propanamide;(2S)-2-(4-chlorophenyl)-2-methoxy-N-[4-[7-(1-methylpyrazol-4-yl)pyrrolo[1,2-a]pyrazin-1-yl]phenyl]acetamide;2-(4-chlorophenyl)-2-methoxy-N-[4-[7-(1-methylpyrazol-4-yl)pyrrolo[1,2-a]pyrazin-1-yl]phenyl]acetamide with MolForge

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Related Compounds

2-(3-chlorophenyl)-N-[4-[7-(1-methylpyrazol-4-yl)pyrrolo[1,2-a]pyrazin-1-yl]phenyl]acetamide;2-(4-chlorophenyl)-N-[4-[7-(1-methylpyrazol-4-yl)pyrrolo[1,2-a]pyrazin-1-yl]phenyl]acetamide;2-methoxy-N-[4-[7-(1-methylpyrazol-4-yl)pyrrolo[1,2-a]pyrazin-1-yl]phenyl]-2-phenylacetamide;N-[4-[7-(4-methylsulfonylphenyl)pyrrolo[1,2-a]pyrazin-1-yl]phenyl]methanesulfonamide
CID 158798932
CID 159500531
CID 159500531
(2R)-2-(4-chlorophenyl)-2-hydroxy-N-[4-[6-(1-methylpyrazol-4-yl)pyrrolo[2,1-f][1,2,4]triazin-4-yl]phenyl]acetamide;(2S)-2-(4-chlorophenyl)-2-hydroxy-N-[4-[6-(1-methylpyrazol-4-yl)pyrrolo[2,1-f][1,2,4]triazin-4-yl]phenyl]acetamide;2-(4-chlorophenyl)-2-hydroxy-N-[4-[6-(1-methylpyrazol-4-yl)pyrrolo[2,1-f][1,2,4]triazin-4-yl]phenyl]acetamide;2-(4-chlorophenyl)-N-[4-[6-(1-methylpyrazol-4-yl)pyrrolo[2,1-f][1,2,4]triazin-4-yl]phenyl]-2-oxoacetamide
CID 159821419
2-amino-2-(4-chlorophenyl)-N-[4-[7-(1-methylpyrazol-4-yl)pyrrolo[1,2-a]pyrazin-1-yl]phenyl]acetamide;(2R)-2-(4-chlorophenyl)-2-hydroxy-N-[4-[7-(1-methylpyrazol-4-yl)pyrrolo[1,2-a]pyrazin-1-yl]phenyl]acetamide;2-(4-chlorophenyl)-2-hydroxy-N-[4-[7-(1-methylpyrazol-4-yl)pyrrolo[1,2-a]pyrazin-1-yl]phenyl]acetamide;(2S)-2-(4-chlorophenyl)-N-[4-[7-(1-methylpyrazol-4-yl)pyrrolo[1,2-a]pyrazin-1-yl]phenyl]propanamide;2-(4-chlorophenyl)-N-[4-[7-(1-methylpyrazol-4-yl)pyrrolo[1,2-a]pyrazin-1-yl]phenyl]propanamide
CID 159899758
(2R)-2-(4-chlorophenyl)-2-hydroxy-N-[4-[6-(1-methylpyrazol-4-yl)pyrrolo[2,1-f][1,2,4]triazin-4-yl]phenyl]acetamide;(2S)-2-(4-chlorophenyl)-2-hydroxy-N-[4-[6-(1-methylpyrazol-4-yl)pyrrolo[2,1-f][1,2,4]triazin-4-yl]phenyl]acetamide
CID 160426642
(2R)-2-(4-chlorophenyl)-2-hydroxy-N-[4-[6-(1-methylpyrazol-4-yl)pyrrolo[2,1-f][1,2,4]triazin-4-yl]phenyl]acetamide;(2S)-2-(4-chlorophenyl)-2-hydroxy-N-[4-[6-(1-methylpyrazol-4-yl)pyrrolo[2,1-f][1,2,4]triazin-4-yl]phenyl]acetamide;2-(4-chlorophenyl)-2-hydroxy-N-[4-[6-(1-methylpyrazol-4-yl)pyrrolo[2,1-f][1,2,4]triazin-4-yl]phenyl]acetamide
CID 160548503
(2S)-2-amino-2-(4-chlorophenyl)-N-[4-[7-(1-methylpyrazol-4-yl)pyrrolo[1,2-a]pyrazin-1-yl]phenyl]propanamide;(2R)-2-amino-2-(4-chlorophenyl)-N-[4-[7-(1-methylpyrazol-4-yl)pyrrolo[1,2-a]pyrazin-1-yl]phenyl]propanamide;2-amino-2-(4-chlorophenyl)-N-[4-[7-(1-methylpyrazol-4-yl)pyrrolo[1,2-a]pyrazin-1-yl]phenyl]propanamide;(2R)-2-(4-chlorophenyl)-2-methoxy-N-[4-[7-(1-methylpyrazol-4-yl)pyrrolo[1,2-a]pyrazin-1-yl]phenyl]acetamide;(2S)-2-(4-chlorophenyl)-N-[4-[7-(1-methylpyrazol-4-yl)pyrrolo[1,2-a]pyrazin-1-yl]phenyl]butanamide
CID 160664502
(2R)-2-(4-chlorophenyl)-2-hydroxy-N-[4-[6-(1-methylpyrazol-4-yl)pyrrolo[2,1-f][1,2,4]triazin-4-yl]phenyl]propanamide;(2S)-2-(4-chlorophenyl)-2-hydroxy-N-[4-[6-(1-methylpyrazol-4-yl)pyrrolo[2,1-f][1,2,4]triazin-4-yl]phenyl]propanamide;2-(4-chlorophenyl)-2-hydroxy-N-[4-[6-(1-methylpyrazol-4-yl)pyrrolo[2,1-f][1,2,4]triazin-4-yl]phenyl]propanamide;2-(4-chlorophenyl)-N-[4-[6-(1-methylpyrazol-4-yl)pyrrolo[2,1-f][1,2,4]triazin-4-yl]phenyl]-2-oxoacetamide
CID 161012349
2-(4-chlorophenyl)-2-(dimethylamino)-N-[4-[6-(1-methylpyrazol-4-yl)pyrrolo[2,1-f][1,2,4]triazin-4-yl]phenyl]acetamide;2-(4-chlorophenyl)-2-hydroxy-N-[4-[6-(1-methylpyrazol-4-yl)pyrrolo[2,1-f][1,2,4]triazin-4-yl]phenyl]acetamide;2-(4-chlorophenyl)-N-[4-[6-(1-methylpyrazol-4-yl)pyrrolo[2,1-f][1,2,4]triazin-4-yl]phenyl]-2-oxoacetamide;2-(4-chlorophenyl)-N-[4-[6-(1-methylpyrazol-4-yl)pyrrolo[2,1-f][1,2,4]triazin-4-yl]phenyl]propanamide;propane
CID 161604831
1-(4-Chlorophenyl)-4-fluoro-3-(oxan-3-yl)pyrazolo[3,4-c]pyridine;1-(4-chlorophenyl)-3-piperidin-4-ylpyrazolo[5,4-c]pyridine;1-(4-fluorophenyl)-3-(oxan-4-yl)pyrazolo[5,4-c]pyridine;2-[1-(4-methylphenyl)pyrazolo[5,4-c]pyridin-3-yl]morpholine;3-[1-(4-methylphenyl)pyrazolo[5,4-c]pyridin-3-yl]morpholine;5-[1-(4-methylphenyl)pyrazolo[5,4-c]pyridin-3-yl]piperidin-2-one
CID 161612083
2-chloro-N-[4-[7-(1-methylpyrazol-4-yl)pyrrolo[1,2-a]pyrazin-1-yl]phenyl]benzenesulfonamide;3-chloro-N-[4-[7-(1-methylpyrazol-4-yl)pyrrolo[1,2-a]pyrazin-1-yl]phenyl]benzenesulfonamide;4-chloro-N-[4-[7-(1-methylpyrazol-4-yl)pyrrolo[1,2-a]pyrazin-1-yl]phenyl]benzenesulfonamide;(2S)-2-(4-chlorophenyl)-2-hydroxy-N-[4-[7-(1-methylpyrazol-4-yl)pyrrolo[1,2-a]pyrazin-1-yl]phenyl]acetamide;4-methoxy-N-[4-[7-(1-methylpyrazol-4-yl)pyrrolo[1,2-a]pyrazin-1-yl]phenyl]benzenesulfonamide
CID 161675105
(2R)-2-(4-chlorophenyl)-2-hydroxy-N-[4-[6-(1-methylpyrazol-4-yl)pyrrolo[2,1-f][1,2,4]triazin-4-yl]phenyl]propanamide;(2S)-2-(4-chlorophenyl)-2-hydroxy-N-[4-[6-(1-methylpyrazol-4-yl)pyrrolo[2,1-f][1,2,4]triazin-4-yl]phenyl]propanamide;2-(4-chlorophenyl)-2-hydroxy-N-[4-[6-(1-methylpyrazol-4-yl)pyrrolo[2,1-f][1,2,4]triazin-4-yl]phenyl]propanamide
CID 161931825

Frequently Asked Questions

What is the IUPAC name of (2S)-2-(4-chlorophenyl)-2-hydroxy-N-[4-[7-(1-methylpyrazol-4-yl)pyrrolo[1,2-a]pyrazin-1-yl]phenyl]propanamide;(2R)-2-(4-chlorophenyl)-2-hydroxy-N-[4-[7-(1-methylpyrazol-4-yl)pyrrolo[1,2-a]pyrazin-1-yl]phenyl]propanamide;2-(4-chlorophenyl)-2-hydroxy-N-[4-[7-(1-methylpyrazol-4-yl)pyrrolo[1,2-a]pyrazin-1-yl]phenyl]propanamide;(2S)-2-(4-chlorophenyl)-2-methoxy-N-[4-[7-(1-methylpyrazol-4-yl)pyrrolo[1,2-a]pyrazin-1-yl]phenyl]acetamide;2-(4-chlorophenyl)-2-methoxy-N-[4-[7-(1-methylpyrazol-4-yl)pyrrolo[1,2-a]pyrazin-1-yl]phenyl]acetamide?
The IUPAC name of (2S)-2-(4-chlorophenyl)-2-hydroxy-N-[4-[7-(1-methylpyrazol-4-yl)pyrrolo[1,2-a]pyrazin-1-yl]phenyl]propanamide;(2R)-2-(4-chlorophenyl)-2-hydroxy-N-[4-[7-(1-methylpyrazol-4-yl)pyrrolo[1,2-a]pyrazin-1-yl]phenyl]propanamide;2-(4-chlorophenyl)-2-hydroxy-N-[4-[7-(1-methylpyrazol-4-yl)pyrrolo[1,2-a]pyrazin-1-yl]phenyl]propanamide;(2S)-2-(4-chlorophenyl)-2-methoxy-N-[4-[7-(1-methylpyrazol-4-yl)pyrrolo[1,2-a]pyrazin-1-yl]phenyl]acetamide;2-(4-chlorophenyl)-2-methoxy-N-[4-[7-(1-methylpyrazol-4-yl)pyrrolo[1,2-a]pyrazin-1-yl]phenyl]acetamide (CID 158070338) is (2S)-2-(4-chlorophenyl)-2-hydroxy-N-[4-[7-(1-methylpyrazol-4-yl)pyrrolo[1,2-a]pyrazin-1-yl]phenyl]propanamide;(2R)-2-(4-chlorophenyl)-2-hydroxy-N-[4-[7-(1-methylpyrazol-4-yl)pyrrolo[1,2-a]pyrazin-1-yl]phenyl]propanamide;2-(4-chlorophenyl)-2-hydroxy-N-[4-[7-(1-methylpyrazol-4-yl)pyrrolo[1,2-a]pyrazin-1-yl]phenyl]propanamide;(2S)-2-(4-chlorophenyl)-2-methoxy-N-[4-[7-(1-methylpyrazol-4-yl)pyrrolo[1,2-a]pyrazin-1-yl]phenyl]acetamide;2-(4-chlorophenyl)-2-methoxy-N-[4-[7-(1-methylpyrazol-4-yl)pyrrolo[1,2-a]pyrazin-1-yl]phenyl]acetamide.
What is the SMILES notation for (2S)-2-(4-chlorophenyl)-2-hydroxy-N-[4-[7-(1-methylpyrazol-4-yl)pyrrolo[1,2-a]pyrazin-1-yl]phenyl]propanamide;(2R)-2-(4-chlorophenyl)-2-hydroxy-N-[4-[7-(1-methylpyrazol-4-yl)pyrrolo[1,2-a]pyrazin-1-yl]phenyl]propanamide;2-(4-chlorophenyl)-2-hydroxy-N-[4-[7-(1-methylpyrazol-4-yl)pyrrolo[1,2-a]pyrazin-1-yl]phenyl]propanamide;(2S)-2-(4-chlorophenyl)-2-methoxy-N-[4-[7-(1-methylpyrazol-4-yl)pyrrolo[1,2-a]pyrazin-1-yl]phenyl]acetamide;2-(4-chlorophenyl)-2-methoxy-N-[4-[7-(1-methylpyrazol-4-yl)pyrrolo[1,2-a]pyrazin-1-yl]phenyl]acetamide?
The canonical SMILES for (2S)-2-(4-chlorophenyl)-2-hydroxy-N-[4-[7-(1-methylpyrazol-4-yl)pyrrolo[1,2-a]pyrazin-1-yl]phenyl]propanamide;(2R)-2-(4-chlorophenyl)-2-hydroxy-N-[4-[7-(1-methylpyrazol-4-yl)pyrrolo[1,2-a]pyrazin-1-yl]phenyl]propanamide;2-(4-chlorophenyl)-2-hydroxy-N-[4-[7-(1-methylpyrazol-4-yl)pyrrolo[1,2-a]pyrazin-1-yl]phenyl]propanamide;(2S)-2-(4-chlorophenyl)-2-methoxy-N-[4-[7-(1-methylpyrazol-4-yl)pyrrolo[1,2-a]pyrazin-1-yl]phenyl]acetamide;2-(4-chlorophenyl)-2-methoxy-N-[4-[7-(1-methylpyrazol-4-yl)pyrrolo[1,2-a]pyrazin-1-yl]phenyl]acetamide is COC(C(=O)Nc1ccc(-c2nccn3cc(-c4cnn(C)c4)cc23)cc1)c1ccc(Cl)cc1.CO[C@H](C(=O)Nc1ccc(-c2nccn3cc(-c4cnn(C)c4)cc23)cc1)c1ccc(Cl)cc1.Cn1cc(-c2cc3c(-c4ccc(NC(=O)C(C)(O)c5ccc(Cl)cc5)cc4)nccn3c2)cn1.Cn1cc(-c2cc3c(-c4ccc(NC(=O)[C@@](C)(O)c5ccc(Cl)cc5)cc4)nccn3c2)cn1.Cn1cc(-c2cc3c(-c4ccc(NC(=O)[C@](C)(O)c5ccc(Cl)cc5)cc4)nccn3c2)cn1.
What is the InChIKey of (2S)-2-(4-chlorophenyl)-2-hydroxy-N-[4-[7-(1-methylpyrazol-4-yl)pyrrolo[1,2-a]pyrazin-1-yl]phenyl]propanamide;(2R)-2-(4-chlorophenyl)-2-hydroxy-N-[4-[7-(1-methylpyrazol-4-yl)pyrrolo[1,2-a]pyrazin-1-yl]phenyl]propanamide;2-(4-chlorophenyl)-2-hydroxy-N-[4-[7-(1-methylpyrazol-4-yl)pyrrolo[1,2-a]pyrazin-1-yl]phenyl]propanamide;(2S)-2-(4-chlorophenyl)-2-methoxy-N-[4-[7-(1-methylpyrazol-4-yl)pyrrolo[1,2-a]pyrazin-1-yl]phenyl]acetamide;2-(4-chlorophenyl)-2-methoxy-N-[4-[7-(1-methylpyrazol-4-yl)pyrrolo[1,2-a]pyrazin-1-yl]phenyl]acetamide?
The InChIKey is FLTAYJLJWNTDRG-XMSSIGKUSA-N. The full InChI is InChI=1S/5C26H22ClN5O2/c3*1-26(34,20-5-7-21(27)8-6-20)25(33)30-22-9-3-17(4-10-22)24-23-13-18(16-32(23)12-11-28-24)19-14-29-31(2)15-19;2*1-31-15-20(14-29-31)19-13-23-24(28-11-12-32(23)16-19)17-5-9-22(10-6-17)30-26(33)25(34-2)18-3-7-21(27)8-4-18/h3*3-16,34H,1-2H3,(H,30,33);2*3-16,25H,1-2H3,(H,30,33)/t2*26-;;25-;/m10.0./s1.
What are the key properties of (2S)-2-(4-chlorophenyl)-2-hydroxy-N-[4-[7-(1-methylpyrazol-4-yl)pyrrolo[1,2-a]pyrazin-1-yl]phenyl]propanamide;(2R)-2-(4-chlorophenyl)-2-hydroxy-N-[4-[7-(1-methylpyrazol-4-yl)pyrrolo[1,2-a]pyrazin-1-yl]phenyl]propanamide;2-(4-chlorophenyl)-2-hydroxy-N-[4-[7-(1-methylpyrazol-4-yl)pyrrolo[1,2-a]pyrazin-1-yl]phenyl]propanamide;(2S)-2-(4-chlorophenyl)-2-methoxy-N-[4-[7-(1-methylpyrazol-4-yl)pyrrolo[1,2-a]pyrazin-1-yl]phenyl]acetamide;2-(4-chlorophenyl)-2-methoxy-N-[4-[7-(1-methylpyrazol-4-yl)pyrrolo[1,2-a]pyrazin-1-yl]phenyl]acetamide?
(2S)-2-(4-chlorophenyl)-2-hydroxy-N-[4-[7-(1-methylpyrazol-4-yl)pyrrolo[1,2-a]pyrazin-1-yl]phenyl]propanamide;(2R)-2-(4-chlorophenyl)-2-hydroxy-N-[4-[7-(1-methylpyrazol-4-yl)pyrrolo[1,2-a]pyrazin-1-yl]phenyl]propanamide;2-(4-chlorophenyl)-2-hydroxy-N-[4-[7-(1-methylpyrazol-4-yl)pyrrolo[1,2-a]pyrazin-1-yl]phenyl]propanamide;(2S)-2-(4-chlorophenyl)-2-methoxy-N-[4-[7-(1-methylpyrazol-4-yl)pyrrolo[1,2-a]pyrazin-1-yl]phenyl]acetamide;2-(4-chlorophenyl)-2-methoxy-N-[4-[7-(1-methylpyrazol-4-yl)pyrrolo[1,2-a]pyrazin-1-yl]phenyl]acetamide has a molecular weight of 2359.74 g/mol, XLogP of 25.47, 27 rotatable bonds, 8 hydrogen bond donors, and 30 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-2-(4-chlorophenyl)-2-hydroxy-N-[4-[7-(1-methylpyrazol-4-yl)pyrrolo[1,2-a]pyrazin-1-yl]phenyl]propanamide;(2R)-2-(4-chlorophenyl)-2-hydroxy-N-[4-[7-(1-methylpyrazol-4-yl)pyrrolo[1,2-a]pyrazin-1-yl]phenyl]propanamide;2-(4-chlorophenyl)-2-hydroxy-N-[4-[7-(1-methylpyrazol-4-yl)pyrrolo[1,2-a]pyrazin-1-yl]phenyl]propanamide;(2S)-2-(4-chlorophenyl)-2-methoxy-N-[4-[7-(1-methylpyrazol-4-yl)pyrrolo[1,2-a]pyrazin-1-yl]phenyl]acetamide;2-(4-chlorophenyl)-2-methoxy-N-[4-[7-(1-methylpyrazol-4-yl)pyrrolo[1,2-a]pyrazin-1-yl]phenyl]acetamide is sourced from PubChem (CID 158070338), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).