(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

C131H115Cl5N28O6 — CID 160664502

IUPAC(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
SMILESCC[C@H](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)(N)c5ccc(Cl)cc5)cc4)nccn3c2)cn1.Cn1cc(-c2cc3c(-c4ccc(NC(=O)[C@@](C)(N)c5ccc(Cl)cc5)cc4)nccn3c2)cn1.Cn1cc(-c2cc3c(-c4ccc(NC(=O)[C@](C)(N)c5ccc(Cl)cc5)cc4)nccn3c2)cn1
InChIInChI=1S/C27H24ClN5O.3C26H23ClN6O.C26H22ClN5O2/c1-3-24(18-4-8-22(28)9-5-18)27(34)31-23-10-6-19(7-11-23)26-25-14-20(17-33(25)13-12-29-26)21-15-30-32(2)16-21;3*1-26(28,20-5-7-21(27)8-6-20)25(34)31-22-9-3-17(4-10-22)24-23-13-18(16-33(23)12-11-29-24)19-14-30-32(2)15-19;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/h4-17,24H,3H2,1-2H3,(H,31,34);3*3-16H,28H2,1-2H3,(H,31,34);3-16,25H,1-2H3,(H,30,33)/t24-;2*26-;;25-/m010.1/s1
InChIKeyRMCMZCHPZNKBTC-WGWYDMMPSA-N
MW2354.82 g/mol
LogP26.17
Rot. Bonds27

About (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

(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 (PubChem CID 160664502) has the molecular formula C131H115Cl5N28O6 and a molecular weight of 2354.82 g/mol. Its IUPAC name is (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.

Molecular Properties

Compound Name(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
PubChem CID160664502
Molecular FormulaC131H115Cl5N28O6
Molecular Weight2354.82 g/mol
Exact Mass2350.80
IUPAC Name(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
SMILESCC[C@H](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)(N)c5ccc(Cl)cc5)cc4)nccn3c2)cn1.Cn1cc(-c2cc3c(-c4ccc(NC(=O)[C@@](C)(N)c5ccc(Cl)cc5)cc4)nccn3c2)cn1.Cn1cc(-c2cc3c(-c4ccc(NC(=O)[C@](C)(N)c5ccc(Cl)cc5)cc4)nccn3c2)cn1
InChIInChI=1S/C27H24ClN5O.3C26H23ClN6O.C26H22ClN5O2/c1-3-24(18-4-8-22(28)9-5-18)27(34)31-23-10-6-19(7-11-23)26-25-14-20(17-33(25)13-12-29-26)21-15-30-32(2)16-21;3*1-26(28,20-5-7-21(27)8-6-20)25(34)31-22-9-3-17(4-10-22)24-23-13-18(16-33(23)12-11-29-24)19-14-30-32(2)15-19;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/h4-17,24H,3H2,1-2H3,(H,31,34);3*3-16H,28H2,1-2H3,(H,31,34);3-16,25H,1-2H3,(H,30,33)/t24-;2*26-;;25-/m010.1/s1
InChIKeyRMCMZCHPZNKBTC-WGWYDMMPSA-N
XLogP26.17
TPSA408.39 Ų
H-Bond Donors8
H-Bond Acceptors29
Rotatable Bonds27
Heavy Atoms170
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5002354.82
LogP ≤ 526.17
H-Bond Donors ≤ 58
H-Bond Acceptors ≤ 1029

Analyze (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 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

(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
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
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
1-(4-chlorophenyl)-4-fluoro-3-(oxan-4-yl)pyrazolo[3,4-c]pyridine;1-(4-chlorophenyl)-3-[1-(1H-pyrazol-5-ylmethyl)piperidin-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 160341348
(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
3-amino-1-[4-[1-(4-chlorophenyl)pyrazolo[5,4-c]pyridin-3-yl]piperidin-1-yl]propan-1-one;4-[1-(4-chlorophenyl)pyrazolo[5,4-c]pyridin-3-yl]-N,N-dimethylpiperidine-1-carboxamide;ethyl 4-[1-(4-chlorophenyl)pyrazolo[5,4-c]pyridin-3-yl]piperidine-1-carboxylate;2-[1-(4-methylphenyl)pyrazolo[5,4-c]pyridin-3-yl]morpholine;4-[1-(4-methylphenyl)pyrazolo[5,4-c]pyridin-3-yl]-1,3-oxazinane;5-[1-(4-methylphenyl)pyrazolo[5,4-c]pyridin-3-yl]piperidin-2-one
CID 161477001
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
(2S)-2-(4-chlorophenyl)-2-methoxy-N-[4-[7-(1-methylpyrazol-4-yl)pyrrolo[1,2-a]pyrazin-1-yl]phenyl]acetamide
CID 158070342
2-(4-chlorophenyl)-2-methoxy-N-[4-[7-(1-methylpyrazol-4-yl)pyrrolo[1,2-a]pyrazin-1-yl]phenyl]acetamide
CID 158070343
(2R)-2-(4-chlorophenyl)-2-methoxy-N-[4-[7-(1-methylpyrazol-4-yl)pyrrolo[1,2-a]pyrazin-1-yl]phenyl]acetamide
CID 160664503

Frequently Asked Questions

What is the IUPAC name of (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?
The IUPAC name of (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) is (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.
What is the SMILES notation for (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?
The canonical SMILES for (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 is CC[C@H](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)(N)c5ccc(Cl)cc5)cc4)nccn3c2)cn1.Cn1cc(-c2cc3c(-c4ccc(NC(=O)[C@@](C)(N)c5ccc(Cl)cc5)cc4)nccn3c2)cn1.Cn1cc(-c2cc3c(-c4ccc(NC(=O)[C@](C)(N)c5ccc(Cl)cc5)cc4)nccn3c2)cn1.
What is the InChIKey of (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?
The InChIKey is RMCMZCHPZNKBTC-WGWYDMMPSA-N. The full InChI is InChI=1S/C27H24ClN5O.3C26H23ClN6O.C26H22ClN5O2/c1-3-24(18-4-8-22(28)9-5-18)27(34)31-23-10-6-19(7-11-23)26-25-14-20(17-33(25)13-12-29-26)21-15-30-32(2)16-21;3*1-26(28,20-5-7-21(27)8-6-20)25(34)31-22-9-3-17(4-10-22)24-23-13-18(16-33(23)12-11-29-24)19-14-30-32(2)15-19;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/h4-17,24H,3H2,1-2H3,(H,31,34);3*3-16H,28H2,1-2H3,(H,31,34);3-16,25H,1-2H3,(H,30,33)/t24-;2*26-;;25-/m010.1/s1.
What are the key properties of (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?
(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 has a molecular weight of 2354.82 g/mol, XLogP of 26.17, 27 rotatable bonds, 8 hydrogen bond donors, and 29 hydrogen bond acceptors.
Where does this data come from?
All data for (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 is sourced from PubChem (CID 160664502), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).