3-amino-6-(1,3-benzothiazol-6-yl)-5-pyrazol-1-ylpyrazine-2-carbonitrile;3-amino-6-(1,3-benzoxazol-6-yl)-5-phenylpyrazine-2-carbonitrile;3-amino-6-(1,3-benzoxazol-6-yl)-5-pyrazol-1-ylpyrazine-2-carbonitrile;5-(7-chloro-3H-benzimidazol-5-yl)-6-pyridin-2-ylpyrazin-2-amine;5-([1,3]oxazolo[5,4-b]pyridin-2-yl)-6-phenylpyrazin-2-amine;6-phenyl-5-(5,6,7,8-tetrahydroquinolin-6-yl)pyrazin-2-amine

C99H69ClN34O3S — CID 160985017

IUPAC3-amino-6-(1,3-benzothiazol-6-yl)-5-pyrazol-1-ylpyrazine-2-carbonitrile;3-amino-6-(1,3-benzoxazol-6-yl)-5-phenylpyrazine-2-carbonitrile;3-amino-6-(1,3-benzoxazol-6-yl)-5-pyrazol-1-ylpyrazine-2-carbonitrile;5-(7-chloro-3H-benzimidazol-5-yl)-6-pyridin-2-ylpyrazin-2-amine;5-([1,3]oxazolo[5,4-b]pyridin-2-yl)-6-phenylpyrazin-2-amine;6-phenyl-5-(5,6,7,8-tetrahydroquinolin-6-yl)pyrazin-2-amine
SMILESN#Cc1nc(-c2ccc3ncoc3c2)c(-c2ccccc2)nc1N.N#Cc1nc(-c2ccc3ncoc3c2)c(-n2cccn2)nc1N.N#Cc1nc(-c2ccc3ncsc3c2)c(-n2cccn2)nc1N.Nc1cnc(-c2cc(Cl)c3nc[nH]c3c2)c(-c2ccccn2)n1.Nc1cnc(-c2nc3cccnc3o2)c(-c2ccccc2)n1.Nc1cnc(C2CCc3ncccc3C2)c(-c2ccccc2)n1
InChIInChI=1S/C19H18N4.C18H11N5O.C16H11ClN6.C16H11N5O.C15H9N7O.C15H9N7S/c20-17-12-22-18(19(23-17)13-5-2-1-3-6-13)15-8-9-16-14(11-15)7-4-10-21-16;19-9-14-18(20)23-16(11-4-2-1-3-5-11)17(22-14)12-6-7-13-15(8-12)24-10-21-13;17-10-5-9(6-12-15(10)22-8-21-12)14-16(23-13(18)7-20-14)11-3-1-2-4-19-11;17-12-9-19-14(13(21-12)10-5-2-1-3-6-10)16-20-11-7-4-8-18-15(11)22-16;2*16-7-11-14(17)21-15(22-5-1-4-19-22)13(20-11)9-2-3-10-12(6-9)23-8-18-10/h1-7,10,12,15H,8-9,11H2,(H2,20,23);1-8,10H,(H2,20,23);1-8H,(H2,18,23)(H,21,22);1-9H,(H2,17,21);2*1-6,8H,(H2,17,21)
InChIKeySZZUWUKFWBODNA-UHFFFAOYSA-N
MW1850.40 g/mol
LogP17.36
Rot. Bonds12

About 3-amino-6-(1,3-benzothiazol-6-yl)-5-pyrazol-1-ylpyrazine-2-carbonitrile;3-amino-6-(1,3-benzoxazol-6-yl)-5-phenylpyrazine-2-carbonitrile;3-amino-6-(1,3-benzoxazol-6-yl)-5-pyrazol-1-ylpyrazine-2-carbonitrile;5-(7-chloro-3H-benzimidazol-5-yl)-6-pyridin-2-ylpyrazin-2-amine;5-([1,3]oxazolo[5,4-b]pyridin-2-yl)-6-phenylpyrazin-2-amine;6-phenyl-5-(5,6,7,8-tetrahydroquinolin-6-yl)pyrazin-2-amine

3-amino-6-(1,3-benzothiazol-6-yl)-5-pyrazol-1-ylpyrazine-2-carbonitrile;3-amino-6-(1,3-benzoxazol-6-yl)-5-phenylpyrazine-2-carbonitrile;3-amino-6-(1,3-benzoxazol-6-yl)-5-pyrazol-1-ylpyrazine-2-carbonitrile;5-(7-chloro-3H-benzimidazol-5-yl)-6-pyridin-2-ylpyrazin-2-amine;5-([1,3]oxazolo[5,4-b]pyridin-2-yl)-6-phenylpyrazin-2-amine;6-phenyl-5-(5,6,7,8-tetrahydroquinolin-6-yl)pyrazin-2-amine (PubChem CID 160985017) has the molecular formula C99H69ClN34O3S and a molecular weight of 1850.40 g/mol. Its IUPAC name is 3-amino-6-(1,3-benzothiazol-6-yl)-5-pyrazol-1-ylpyrazine-2-carbonitrile;3-amino-6-(1,3-benzoxazol-6-yl)-5-phenylpyrazine-2-carbonitrile;3-amino-6-(1,3-benzoxazol-6-yl)-5-pyrazol-1-ylpyrazine-2-carbonitrile;5-(7-chloro-3H-benzimidazol-5-yl)-6-pyridin-2-ylpyrazin-2-amine;5-([1,3]oxazolo[5,4-b]pyridin-2-yl)-6-phenylpyrazin-2-amine;6-phenyl-5-(5,6,7,8-tetrahydroquinolin-6-yl)pyrazin-2-amine.

Molecular Properties

Compound Name3-amino-6-(1,3-benzothiazol-6-yl)-5-pyrazol-1-ylpyrazine-2-carbonitrile;3-amino-6-(1,3-benzoxazol-6-yl)-5-phenylpyrazine-2-carbonitrile;3-amino-6-(1,3-benzoxazol-6-yl)-5-pyrazol-1-ylpyrazine-2-carbonitrile;5-(7-chloro-3H-benzimidazol-5-yl)-6-pyridin-2-ylpyrazin-2-amine;5-([1,3]oxazolo[5,4-b]pyridin-2-yl)-6-phenylpyrazin-2-amine;6-phenyl-5-(5,6,7,8-tetrahydroquinolin-6-yl)pyrazin-2-amine
PubChem CID160985017
Molecular FormulaC99H69ClN34O3S
Molecular Weight1850.40 g/mol
Exact Mass1848.57
IUPAC Name3-amino-6-(1,3-benzothiazol-6-yl)-5-pyrazol-1-ylpyrazine-2-carbonitrile;3-amino-6-(1,3-benzoxazol-6-yl)-5-phenylpyrazine-2-carbonitrile;3-amino-6-(1,3-benzoxazol-6-yl)-5-pyrazol-1-ylpyrazine-2-carbonitrile;5-(7-chloro-3H-benzimidazol-5-yl)-6-pyridin-2-ylpyrazin-2-amine;5-([1,3]oxazolo[5,4-b]pyridin-2-yl)-6-phenylpyrazin-2-amine;6-phenyl-5-(5,6,7,8-tetrahydroquinolin-6-yl)pyrazin-2-amine
SMILESN#Cc1nc(-c2ccc3ncoc3c2)c(-c2ccccc2)nc1N.N#Cc1nc(-c2ccc3ncoc3c2)c(-n2cccn2)nc1N.N#Cc1nc(-c2ccc3ncsc3c2)c(-n2cccn2)nc1N.Nc1cnc(-c2cc(Cl)c3nc[nH]c3c2)c(-c2ccccn2)n1.Nc1cnc(-c2nc3cccnc3o2)c(-c2ccccc2)n1.Nc1cnc(C2CCc3ncccc3C2)c(-c2ccccc2)n1
InChIInChI=1S/C19H18N4.C18H11N5O.C16H11ClN6.C16H11N5O.C15H9N7O.C15H9N7S/c20-17-12-22-18(19(23-17)13-5-2-1-3-6-13)15-8-9-16-14(11-15)7-4-10-21-16;19-9-14-18(20)23-16(11-4-2-1-3-5-11)17(22-14)12-6-7-13-15(8-12)24-10-21-13;17-10-5-9(6-12-15(10)22-8-21-12)14-16(23-13(18)7-20-14)11-3-1-2-4-19-11;17-12-9-19-14(13(21-12)10-5-2-1-3-6-10)16-20-11-7-4-8-18-15(11)22-16;2*16-7-11-14(17)21-15(22-5-1-4-19-22)13(20-11)9-2-3-10-12(6-9)23-8-18-10/h1-7,10,12,15H,8-9,11H2,(H2,20,23);1-8,10H,(H2,20,23);1-8H,(H2,18,23)(H,21,22);1-9H,(H2,17,21);2*1-6,8H,(H2,17,21)
InChIKeySZZUWUKFWBODNA-UHFFFAOYSA-N
XLogP17.36
TPSA576.14 Ų
H-Bond Donors7
H-Bond Acceptors37
Rotatable Bonds12
Heavy Atoms138
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5001850.40
LogP ≤ 517.36
H-Bond Donors ≤ 57
H-Bond Acceptors ≤ 1037

Analyze 3-amino-6-(1,3-benzothiazol-6-yl)-5-pyrazol-1-ylpyrazine-2-carbonitrile;3-amino-6-(1,3-benzoxazol-6-yl)-5-phenylpyrazine-2-carbonitrile;3-amino-6-(1,3-benzoxazol-6-yl)-5-pyrazol-1-ylpyrazine-2-carbonitrile;5-(7-chloro-3H-benzimidazol-5-yl)-6-pyridin-2-ylpyrazin-2-amine;5-([1,3]oxazolo[5,4-b]pyridin-2-yl)-6-phenylpyrazin-2-amine;6-phenyl-5-(5,6,7,8-tetrahydroquinolin-6-yl)pyrazin-2-amine with MolForge

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Launch Full Analysis

Related Compounds

6-[5-amino-6-chloro-3-(1-methylimidazol-4-yl)pyrazin-2-yl]-8-chloro-1H-quinolin-2-one;6-[5-amino-3-(3-methylpyrazol-1-yl)-6-(trifluoromethyl)pyrazin-2-yl]-1H-quinolin-4-one;5-(7-chloro-3H-benzimidazol-5-yl)-6-(3-methylpyrazol-1-yl)-3-(trifluoromethoxy)pyrazin-2-amine;3-chloro-5-(8-chloroquinolin-6-yl)-6-(5-methyl-1,3-thiazol-2-yl)pyrazin-2-amine;3-fluoro-6-(5-methylfuran-2-yl)-5-quinolin-6-ylpyrazin-2-amine
CID 157085973
1-[6-amino-3-(4-chloro-1,3-benzothiazol-6-yl)pyrazin-2-yl]pyridin-2-one;1-[6-amino-3-(4-chloro-1,3-benzoxazol-6-yl)pyrazin-2-yl]pyridin-2-one;5-(4-chloro-1,3-benzothiazol-6-yl)-6-(2-methyl-1,3-thiazol-5-yl)pyrazin-2-amine;5-(4-chloro-1,3-benzoxazol-6-yl)-6-(2-methyl-1,3-thiazol-5-yl)pyrazin-2-amine;5-(8-chloroquinolin-6-yl)-3-[3-(diethylamino)propyl]-6-(1-methylpyrazol-3-yl)pyrazin-2-amine;N-[5-(8-chloroquinolin-6-yl)-6-(3-methylpyrazol-1-yl)pyrazin-2-yl]benzamide
CID 157049985
1-[6-amino-3-(7-chloro-1,3-benzothiazol-5-yl)-5-cyclopropylpyrazin-2-yl]pyridin-2-one;5-(7-chloro-3H-benzimidazol-5-yl)-3-cyclobutyl-6-(5-methyl-1,3-thiazol-2-yl)pyrazin-2-amine;5-(7-chloro-1,2-benzoxazol-5-yl)-3-cyclobutyl-6-(3-methylpyrazol-1-yl)pyrazin-2-amine;5-(7-chloro-1,3-benzoxazol-5-yl)-3-cyclopentyl-6-(1-methylpyrazol-3-yl)pyrazin-2-amine;5-(8-chloroquinolin-6-yl)-3-cyclopropyl-6-(5-methylfuran-2-yl)pyrazin-2-amine
CID 157127258
1,2-dimethylbenzimidazole;2,4-dimethyl-1,3-benzoxazole;2,5-dimethyl-1,3-benzoxazole;2,6-dimethyl-1,3-benzoxazole;2,7-dimethyl-1,3-benzoxazole;ethylbenzene;5-ethyl-2-methyltetrazole;2-ethyl-[1,3]oxazolo[4,5-c]pyridine;2-ethyl-[1,3]oxazolo[5,4-c]pyridine;3-ethylpyridazine;2-ethylpyridine;2-methyl-1H-benzimidazole;2-methyl-1,3-benzothiazole;2-methyl-1,3-benzoxazole;2-methyl-[1,3]oxazolo[4,5-b]pyridine;2-methyl-[1,3]oxazolo[5,4-b]pyridine;6-methyl-[1,3]oxazolo[4,5-c]pyridazine;2-methylpyrazine;2-methylpyrimidine;4-methylpyrimidine
CID 157203568
6-(1,3-benzoxazol-6-yl)-7-(2-methyl-1,3-thiazol-5-yl)-1H-1,8-naphthyridin-4-one;6-(1,3-benzoxazol-6-yl)-7-(5-methylthiophen-2-yl)-1H-1,8-naphthyridin-4-one;6-(4-chloro-1,3-benzoxazol-6-yl)-7-(5-methylfuran-2-yl)-1H-1,8-naphthyridin-4-one;6-(4-chloro-1,3-benzoxazol-6-yl)-7-(1-methylpyrazol-3-yl)-1H-1,8-naphthyridin-4-one;6-(4-chloro-1,3-benzoxazol-6-yl)-7-(3-methylpyrazol-1-yl)-1H-1,8-naphthyridin-4-one;6-(4-chloro-1,3-benzoxazol-6-yl)-7-(5-methylthiophen-2-yl)-1H-1,8-naphthyridin-4-one
CID 157220260
6-tert-butyl-1H-benzimidazole;5-tert-butyl-1,3-benzothiazol-2-amine;6-tert-butyl-1,3-benzothiazol-2-amine;5-tert-butyl-1,3-benzothiazole;6-tert-butyl-1,3-benzothiazole;5-tert-butyl-1,3-benzoxazol-2-amine;6-tert-butyl-4-chloro-1H-benzimidazole;2-tert-butyl-4-chlorocyclohexa-2,4-dien-1-one;3-tert-butyl-5-chloropyridin-2-amine;2-tert-butylcyclohexa-2,4-dien-1-one;5-tert-butylfuro[2,3-b]pyridine;6-tert-butylfuro[3,2-b]pyridine;6-tert-butyl-4-methyl-1H-benzimidazole;5-tert-butyl-2-methyl-1,3-benzothiazole;6-tert-butyl-2-methyl-1,3-benzothiazole;5-tert-butyl-2-methyl-1,3-benzoxazole;2-tert-butyl-4-methylcyclohexa-2,4-dien-1-one;3-tert-butylquinoline;5-tert-butylthieno[2,3-b]pyridine;6-tert-butylthieno[3,2-b]pyridine
CID 157348655
5-tert-butyl-1,3-benzothiazol-2-amine;6-tert-butyl-1,3-benzothiazol-2-amine;6-tert-butyl-1,3-benzoxazol-2-amine;6-tert-butyl-4-chloro-1H-benzimidazole;2-tert-butyl-4-chlorocyclohexa-2,4-dien-1-one;2-tert-butyl-7-chloro-1-methylpyrrolo[2,3-c]pyridine;3-tert-butyl-5-chloropyridin-2-amine;2-tert-butyl-7-chloro-1H-pyrrolo[2,3-c]pyridine;2-tert-butylcyclohexa-2,4-dien-1-one;2-tert-butylfuro[3,2-c]pyridin-6-amine;2-tert-butyl-1-methylpyrrolo[2,3-c]pyridin-4-amine;bis(2-tert-butyl-1-methylpyrrolo[3,2-c]pyridin-6-amine);3-tert-butylpyridin-2-amine;2-tert-butyl-1H-pyrrolo[2,3-c]pyridin-4-amine;2-tert-butylthieno[3,2-c]pyridin-6-amine
CID 157412958
4-chloro-6-propan-2-yl-1H-benzimidazole;4-chloro-6-propan-2-yl-1,3-benzothiazole;4-chloro-6-propan-2-yl-1,3-benzoxazole;7-chloro-5-propan-2-yl-1H-indazole;8-chloro-6-propan-2-ylquinoline;8-methyl-6-propan-2-ylquinoline;6-propan-2-yl-1H-benzimidazole;6-propan-2-yl-1,3-benzothiazole;6-propan-2-yl-1,3-benzoxazole;5-propan-2-yl-1H-indazole;6-propan-2-ylquinoline
CID 157450097
2-tert-butyl-1-benzofuran;5-tert-butyl-1,3-benzothiazol-2-amine;6-tert-butyl-1,3-benzothiazol-2-amine;2-tert-butyl-1,3-benzothiazole;2-tert-butyl-1-benzothiophene;6-tert-butyl-1,3-benzoxazol-2-amine;2-tert-butyl-1,3-benzoxazole;6-tert-butyl-4-chloro-1H-benzimidazole;2-tert-butyl-4-chlorocyclohexa-2,4-dien-1-one;3-tert-butyl-5-chloropyridin-2-amine;2-tert-butylcyclohexa-2,4-dien-1-one;3-tert-butyl-7H-cyclopenta[b]pyridine;2-tert-butylfuro[2,3-c]pyridine;2-tert-butylfuro[3,2-c]pyridine;6-tert-butylisoquinoline;2-tert-butyl-1-methylpyrrolo[3,2-c]pyridin-6-amine;3-tert-butylpyridin-2-amine;2-tert-butyl-1H-pyrrolo[3,2-b]pyridine;2-tert-butyl-1H-pyrrolo[2,3-c]pyridine;2-tert-butyl-1H-pyrrolo[3,2-c]pyridine;2-tert-butylthieno[2,3-c]pyridine;2-tert-butylthieno[3,2-c]pyridine
CID 157679099
6-tert-butyl-1H-benzimidazole;2-tert-butyl-1-benzofuran;2-tert-butyl-1,3-benzothiazole;2-tert-butyl-1-benzothiophene;2-tert-butyl-1,3-benzoxazole;2-tert-butyl-4-chloro-1,3-benzothiazole;bis(5-tert-butyl-3-chloro-1-methylpyrrolo[2,3-b]pyridine);3-tert-butyl-7H-cyclopenta[b]pyridine;5-tert-butylfuro[2,3-b]pyridine;6-tert-butylfuro[3,2-b]pyridine;2-tert-butylfuro[2,3-c]pyridine;2-tert-butylfuro[3,2-c]pyridine;6-tert-butylisoquinoline;2-tert-butyl-1H-pyrrolo[3,2-b]pyridine;2-tert-butyl-1H-pyrrolo[2,3-c]pyridine;2-tert-butyl-1H-pyrrolo[3,2-c]pyridine;3-tert-butylquinoline;2-tert-butylthieno[2,3-c]pyridine;2-tert-butylthieno[3,2-c]pyridine;5-tert-butylthiophene-2-carbonitrile;5-tert-butylthiophene-2-carboximidamide
CID 157829460
1H-benzimidazole;1-(2-chlorophenyl)pyrazole;2,3-dihydro-1H-benzo[de]isoquinoline;2,3-dihydro-1H-indole;1-(2-fluorophenyl)pyrazole;1-(3-fluorophenyl)pyrazole;1-(3-methoxyphenyl)pyrazole;5-methyl-3-phenyl-1,2,4-oxadiazole;1-(3-methylphenyl)pyrazole;1-(4-methylphenyl)pyrazole;1,6-naphthyridine;2-pyridin-3-yl-1,3-oxazole;3-pyridin-3-yl-1,2-oxazole;2-(3H-pyrrol-5-yl)pyridine;3-(1H-pyrrol-2-yl)pyridine;4-(3H-pyrrol-5-yl)pyridine;quinoline;5,6,7,8-tetrahydro-1,6-naphthyridine;thieno[2,3-b]pyrazine
CID 157830014
3-tert-butyl-5-(7-chloro-3H-benzimidazol-5-yl)-6-(5-methylthiophen-2-yl)pyrazin-2-amine;5-(7-chloro-4-methyl-1,3-benzoxazol-5-yl)-3-methyl-6-(3-methylpyrazol-1-yl)pyrazin-2-amine;5-(7-chloro-3-methyl-2H-indazol-5-yl)-3-N,3-N-dimethyl-6-phenylpyrazine-2,3-diamine;5-(8-chloroquinolin-6-yl)-6-(5-methylfuran-3-yl)-3-propan-2-ylpyrazin-2-amine;5-(8-chloroquinolin-6-yl)-3-methyl-6-(2-methyl-1,3-thiazol-5-yl)pyrazin-2-amine
CID 157996299

Frequently Asked Questions

What is the IUPAC name of 3-amino-6-(1,3-benzothiazol-6-yl)-5-pyrazol-1-ylpyrazine-2-carbonitrile;3-amino-6-(1,3-benzoxazol-6-yl)-5-phenylpyrazine-2-carbonitrile;3-amino-6-(1,3-benzoxazol-6-yl)-5-pyrazol-1-ylpyrazine-2-carbonitrile;5-(7-chloro-3H-benzimidazol-5-yl)-6-pyridin-2-ylpyrazin-2-amine;5-([1,3]oxazolo[5,4-b]pyridin-2-yl)-6-phenylpyrazin-2-amine;6-phenyl-5-(5,6,7,8-tetrahydroquinolin-6-yl)pyrazin-2-amine?
The IUPAC name of 3-amino-6-(1,3-benzothiazol-6-yl)-5-pyrazol-1-ylpyrazine-2-carbonitrile;3-amino-6-(1,3-benzoxazol-6-yl)-5-phenylpyrazine-2-carbonitrile;3-amino-6-(1,3-benzoxazol-6-yl)-5-pyrazol-1-ylpyrazine-2-carbonitrile;5-(7-chloro-3H-benzimidazol-5-yl)-6-pyridin-2-ylpyrazin-2-amine;5-([1,3]oxazolo[5,4-b]pyridin-2-yl)-6-phenylpyrazin-2-amine;6-phenyl-5-(5,6,7,8-tetrahydroquinolin-6-yl)pyrazin-2-amine (CID 160985017) is 3-amino-6-(1,3-benzothiazol-6-yl)-5-pyrazol-1-ylpyrazine-2-carbonitrile;3-amino-6-(1,3-benzoxazol-6-yl)-5-phenylpyrazine-2-carbonitrile;3-amino-6-(1,3-benzoxazol-6-yl)-5-pyrazol-1-ylpyrazine-2-carbonitrile;5-(7-chloro-3H-benzimidazol-5-yl)-6-pyridin-2-ylpyrazin-2-amine;5-([1,3]oxazolo[5,4-b]pyridin-2-yl)-6-phenylpyrazin-2-amine;6-phenyl-5-(5,6,7,8-tetrahydroquinolin-6-yl)pyrazin-2-amine.
What is the SMILES notation for 3-amino-6-(1,3-benzothiazol-6-yl)-5-pyrazol-1-ylpyrazine-2-carbonitrile;3-amino-6-(1,3-benzoxazol-6-yl)-5-phenylpyrazine-2-carbonitrile;3-amino-6-(1,3-benzoxazol-6-yl)-5-pyrazol-1-ylpyrazine-2-carbonitrile;5-(7-chloro-3H-benzimidazol-5-yl)-6-pyridin-2-ylpyrazin-2-amine;5-([1,3]oxazolo[5,4-b]pyridin-2-yl)-6-phenylpyrazin-2-amine;6-phenyl-5-(5,6,7,8-tetrahydroquinolin-6-yl)pyrazin-2-amine?
The canonical SMILES for 3-amino-6-(1,3-benzothiazol-6-yl)-5-pyrazol-1-ylpyrazine-2-carbonitrile;3-amino-6-(1,3-benzoxazol-6-yl)-5-phenylpyrazine-2-carbonitrile;3-amino-6-(1,3-benzoxazol-6-yl)-5-pyrazol-1-ylpyrazine-2-carbonitrile;5-(7-chloro-3H-benzimidazol-5-yl)-6-pyridin-2-ylpyrazin-2-amine;5-([1,3]oxazolo[5,4-b]pyridin-2-yl)-6-phenylpyrazin-2-amine;6-phenyl-5-(5,6,7,8-tetrahydroquinolin-6-yl)pyrazin-2-amine is N#Cc1nc(-c2ccc3ncoc3c2)c(-c2ccccc2)nc1N.N#Cc1nc(-c2ccc3ncoc3c2)c(-n2cccn2)nc1N.N#Cc1nc(-c2ccc3ncsc3c2)c(-n2cccn2)nc1N.Nc1cnc(-c2cc(Cl)c3nc[nH]c3c2)c(-c2ccccn2)n1.Nc1cnc(-c2nc3cccnc3o2)c(-c2ccccc2)n1.Nc1cnc(C2CCc3ncccc3C2)c(-c2ccccc2)n1.
What is the InChIKey of 3-amino-6-(1,3-benzothiazol-6-yl)-5-pyrazol-1-ylpyrazine-2-carbonitrile;3-amino-6-(1,3-benzoxazol-6-yl)-5-phenylpyrazine-2-carbonitrile;3-amino-6-(1,3-benzoxazol-6-yl)-5-pyrazol-1-ylpyrazine-2-carbonitrile;5-(7-chloro-3H-benzimidazol-5-yl)-6-pyridin-2-ylpyrazin-2-amine;5-([1,3]oxazolo[5,4-b]pyridin-2-yl)-6-phenylpyrazin-2-amine;6-phenyl-5-(5,6,7,8-tetrahydroquinolin-6-yl)pyrazin-2-amine?
The InChIKey is SZZUWUKFWBODNA-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H18N4.C18H11N5O.C16H11ClN6.C16H11N5O.C15H9N7O.C15H9N7S/c20-17-12-22-18(19(23-17)13-5-2-1-3-6-13)15-8-9-16-14(11-15)7-4-10-21-16;19-9-14-18(20)23-16(11-4-2-1-3-5-11)17(22-14)12-6-7-13-15(8-12)24-10-21-13;17-10-5-9(6-12-15(10)22-8-21-12)14-16(23-13(18)7-20-14)11-3-1-2-4-19-11;17-12-9-19-14(13(21-12)10-5-2-1-3-6-10)16-20-11-7-4-8-18-15(11)22-16;2*16-7-11-14(17)21-15(22-5-1-4-19-22)13(20-11)9-2-3-10-12(6-9)23-8-18-10/h1-7,10,12,15H,8-9,11H2,(H2,20,23);1-8,10H,(H2,20,23);1-8H,(H2,18,23)(H,21,22);1-9H,(H2,17,21);2*1-6,8H,(H2,17,21).
What are the key properties of 3-amino-6-(1,3-benzothiazol-6-yl)-5-pyrazol-1-ylpyrazine-2-carbonitrile;3-amino-6-(1,3-benzoxazol-6-yl)-5-phenylpyrazine-2-carbonitrile;3-amino-6-(1,3-benzoxazol-6-yl)-5-pyrazol-1-ylpyrazine-2-carbonitrile;5-(7-chloro-3H-benzimidazol-5-yl)-6-pyridin-2-ylpyrazin-2-amine;5-([1,3]oxazolo[5,4-b]pyridin-2-yl)-6-phenylpyrazin-2-amine;6-phenyl-5-(5,6,7,8-tetrahydroquinolin-6-yl)pyrazin-2-amine?
3-amino-6-(1,3-benzothiazol-6-yl)-5-pyrazol-1-ylpyrazine-2-carbonitrile;3-amino-6-(1,3-benzoxazol-6-yl)-5-phenylpyrazine-2-carbonitrile;3-amino-6-(1,3-benzoxazol-6-yl)-5-pyrazol-1-ylpyrazine-2-carbonitrile;5-(7-chloro-3H-benzimidazol-5-yl)-6-pyridin-2-ylpyrazin-2-amine;5-([1,3]oxazolo[5,4-b]pyridin-2-yl)-6-phenylpyrazin-2-amine;6-phenyl-5-(5,6,7,8-tetrahydroquinolin-6-yl)pyrazin-2-amine has a molecular weight of 1850.40 g/mol, XLogP of 17.36, 12 rotatable bonds, 7 hydrogen bond donors, and 37 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-6-(1,3-benzothiazol-6-yl)-5-pyrazol-1-ylpyrazine-2-carbonitrile;3-amino-6-(1,3-benzoxazol-6-yl)-5-phenylpyrazine-2-carbonitrile;3-amino-6-(1,3-benzoxazol-6-yl)-5-pyrazol-1-ylpyrazine-2-carbonitrile;5-(7-chloro-3H-benzimidazol-5-yl)-6-pyridin-2-ylpyrazin-2-amine;5-([1,3]oxazolo[5,4-b]pyridin-2-yl)-6-phenylpyrazin-2-amine;6-phenyl-5-(5,6,7,8-tetrahydroquinolin-6-yl)pyrazin-2-amine is sourced from PubChem (CID 160985017), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).