benzyl (3R)-3-(1-bromoimidazo[1,5-a]pyrazin-3-yl)piperidine-1-carboxylate;benzyl (3R)-3-[1-[4-(2-fluoro-3-methoxyphenoxy)phenyl]imidazo[1,5-a]pyrazin-3-yl]piperidine-1-carboxylate;benzyl (3R)-3-imidazo[1,5-a]pyrazin-3-ylpiperidine-1-carboxylate;benzyl (3R)-3-(pyrazin-2-ylmethylcarbamoyl)piperidine-1-carboxylate;[4-(2-fluoro-3-methoxyphenoxy)phenyl]boronic acid;1-[(3R)-3-[1-[4-(2-fluoro-3-methoxyphenoxy)phenyl]imidazo[1,5-a]pyrazin-3-yl]piperidin-1-yl]prop-2-en-1-one;1-[4-(2-fluoro-3-methoxyphenoxy)phenyl]-3-[(3R)-piperidin-3-yl]imidazo[1,5-a]pyrazine;methane;(3R)-1-phenylmethoxycarbonylpiperidine-3-carboxylic acid;prop-2-enoyl chloride;pyrazine-2-carbonitrile;pyrazin-2-ylmethanamine

C187H208BBrClF4N31O25 — CID 158243500

IUPACbenzyl (3R)-3-(1-bromoimidazo[1,5-a]pyrazin-3-yl)piperidine-1-carboxylate;benzyl (3R)-3-[1-[4-(2-fluoro-3-methoxyphenoxy)phenyl]imidazo[1,5-a]pyrazin-3-yl]piperidine-1-carboxylate;benzyl (3R)-3-imidazo[1,5-a]pyrazin-3-ylpiperidine-1-carboxylate;benzyl (3R)-3-(pyrazin-2-ylmethylcarbamoyl)piperidine-1-carboxylate;[4-(2-fluoro-3-methoxyphenoxy)phenyl]boronic acid;1-[(3R)-3-[1-[4-(2-fluoro-3-methoxyphenoxy)phenyl]imidazo[1,5-a]pyrazin-3-yl]piperidin-1-yl]prop-2-en-1-one;1-[4-(2-fluoro-3-methoxyphenoxy)phenyl]-3-[(3R)-piperidin-3-yl]imidazo[1,5-a]pyrazine;methane;(3R)-1-phenylmethoxycarbonylpiperidine-3-carboxylic acid;prop-2-enoyl chloride;pyrazine-2-carbonitrile;pyrazin-2-ylmethanamine
SMILESC.C.C.C.C.C.C.C=CC(=O)Cl.C=CC(=O)N1CCC[C@@H](c2nc(-c3ccc(Oc4cccc(OC)c4F)cc3)c3cnccn23)C1.COc1cccc(Oc2ccc(-c3nc([C@@H]4CCCN(C(=O)OCc5ccccc5)C4)n4ccncc34)cc2)c1F.COc1cccc(Oc2ccc(-c3nc([C@@H]4CCCNC4)n4ccncc34)cc2)c1F.COc1cccc(Oc2ccc(B(O)O)cc2)c1F.N#Cc1cnccn1.NCc1cnccn1.O=C(NCc1cnccn1)[C@@H]1CCCN(C(=O)OCc2ccccc2)C1.O=C(O)[C@@H]1CCCN(C(=O)OCc2ccccc2)C1.O=C(OCc1ccccc1)N1CCC[C@@H](c2nc(Br)c3cnccn23)C1.O=C(OCc1ccccc1)N1CCC[C@@H](c2ncc3cnccn23)C1
InChIInChI=1S/C32H29FN4O4.C27H25FN4O3.C24H23FN4O2.C19H19BrN4O2.C19H22N4O3.C19H20N4O2.C14H17NO4.C13H12BFO4.C5H7N3.C5H3N3.C3H3ClO.7CH4/c1-39-27-10-5-11-28(29(27)33)41-25-14-12-23(13-15-25)30-26-19-34-16-18-37(26)31(35-30)24-9-6-17-36(20-24)32(38)40-21-22-7-3-2-4-8-22;1-3-24(33)31-14-5-6-19(17-31)27-30-26(21-16-29-13-15-32(21)27)18-9-11-20(12-10-18)35-23-8-4-7-22(34-2)25(23)28;1-30-20-5-2-6-21(22(20)25)31-18-9-7-16(8-10-18)23-19-15-27-12-13-29(19)24(28-23)17-4-3-11-26-14-17;20-17-16-11-21-8-10-24(16)18(22-17)15-7-4-9-23(12-15)19(25)26-13-14-5-2-1-3-6-14;24-18(22-12-17-11-20-8-9-21-17)16-7-4-10-23(13-16)19(25)26-14-15-5-2-1-3-6-15;24-19(25-14-15-5-2-1-3-6-15)22-9-4-7-16(13-22)18-21-12-17-11-20-8-10-23(17)18;16-13(17)12-7-4-8-15(9-12)14(18)19-10-11-5-2-1-3-6-11;1-18-11-3-2-4-12(13(11)15)19-10-7-5-9(6-8-10)14(16)17;2*6-3-5-4-7-1-2-8-5;1-2-3(4)5;;;;;;;/h2-5,7-8,10-16,18-19,24H,6,9,17,20-21H2,1H3;3-4,7-13,15-16,19H,1,5-6,14,17H2,2H3;2,5-10,12-13,15,17,26H,3-4,11,14H2,1H3;1-3,5-6,8,10-11,15H,4,7,9,12-13H2;1-3,5-6,8-9,11,16H,4,7,10,12-14H2,(H,22,24);1-3,5-6,8,10-12,16H,4,7,9,13-14H2;1-3,5-6,12H,4,7-10H2,(H,16,17);2-8,16-17H,1H3;1-2,4H,3,6H2;1-2,4H;2H,1H2;7*1H4/t24-;19-;17-;15-;2*16-;12-;;;;;;;;;;;/m1111111.........../s1
InChIKeyGFVOCOLAMMDOPO-GBPBRKKZSA-N
MW3492.07 g/mol
LogP35.38
Rot. Bonds38

About benzyl (3R)-3-(1-bromoimidazo[1,5-a]pyrazin-3-yl)piperidine-1-carboxylate;benzyl (3R)-3-[1-[4-(2-fluoro-3-methoxyphenoxy)phenyl]imidazo[1,5-a]pyrazin-3-yl]piperidine-1-carboxylate;benzyl (3R)-3-imidazo[1,5-a]pyrazin-3-ylpiperidine-1-carboxylate;benzyl (3R)-3-(pyrazin-2-ylmethylcarbamoyl)piperidine-1-carboxylate;[4-(2-fluoro-3-methoxyphenoxy)phenyl]boronic acid;1-[(3R)-3-[1-[4-(2-fluoro-3-methoxyphenoxy)phenyl]imidazo[1,5-a]pyrazin-3-yl]piperidin-1-yl]prop-2-en-1-one;1-[4-(2-fluoro-3-methoxyphenoxy)phenyl]-3-[(3R)-piperidin-3-yl]imidazo[1,5-a]pyrazine;methane;(3R)-1-phenylmethoxycarbonylpiperidine-3-carboxylic acid;prop-2-enoyl chloride;pyrazine-2-carbonitrile;pyrazin-2-ylmethanamine

benzyl (3R)-3-(1-bromoimidazo[1,5-a]pyrazin-3-yl)piperidine-1-carboxylate;benzyl (3R)-3-[1-[4-(2-fluoro-3-methoxyphenoxy)phenyl]imidazo[1,5-a]pyrazin-3-yl]piperidine-1-carboxylate;benzyl (3R)-3-imidazo[1,5-a]pyrazin-3-ylpiperidine-1-carboxylate;benzyl (3R)-3-(pyrazin-2-ylmethylcarbamoyl)piperidine-1-carboxylate;[4-(2-fluoro-3-methoxyphenoxy)phenyl]boronic acid;1-[(3R)-3-[1-[4-(2-fluoro-3-methoxyphenoxy)phenyl]imidazo[1,5-a]pyrazin-3-yl]piperidin-1-yl]prop-2-en-1-one;1-[4-(2-fluoro-3-methoxyphenoxy)phenyl]-3-[(3R)-piperidin-3-yl]imidazo[1,5-a]pyrazine;methane;(3R)-1-phenylmethoxycarbonylpiperidine-3-carboxylic acid;prop-2-enoyl chloride;pyrazine-2-carbonitrile;pyrazin-2-ylmethanamine (PubChem CID 158243500) has the molecular formula C187H208BBrClF4N31O25 and a molecular weight of 3492.07 g/mol. Its IUPAC name is benzyl (3R)-3-(1-bromoimidazo[1,5-a]pyrazin-3-yl)piperidine-1-carboxylate;benzyl (3R)-3-[1-[4-(2-fluoro-3-methoxyphenoxy)phenyl]imidazo[1,5-a]pyrazin-3-yl]piperidine-1-carboxylate;benzyl (3R)-3-imidazo[1,5-a]pyrazin-3-ylpiperidine-1-carboxylate;benzyl (3R)-3-(pyrazin-2-ylmethylcarbamoyl)piperidine-1-carboxylate;[4-(2-fluoro-3-methoxyphenoxy)phenyl]boronic acid;1-[(3R)-3-[1-[4-(2-fluoro-3-methoxyphenoxy)phenyl]imidazo[1,5-a]pyrazin-3-yl]piperidin-1-yl]prop-2-en-1-one;1-[4-(2-fluoro-3-methoxyphenoxy)phenyl]-3-[(3R)-piperidin-3-yl]imidazo[1,5-a]pyrazine;methane;(3R)-1-phenylmethoxycarbonylpiperidine-3-carboxylic acid;prop-2-enoyl chloride;pyrazine-2-carbonitrile;pyrazin-2-ylmethanamine.

Molecular Properties

Compound Namebenzyl (3R)-3-(1-bromoimidazo[1,5-a]pyrazin-3-yl)piperidine-1-carboxylate;benzyl (3R)-3-[1-[4-(2-fluoro-3-methoxyphenoxy)phenyl]imidazo[1,5-a]pyrazin-3-yl]piperidine-1-carboxylate;benzyl (3R)-3-imidazo[1,5-a]pyrazin-3-ylpiperidine-1-carboxylate;benzyl (3R)-3-(pyrazin-2-ylmethylcarbamoyl)piperidine-1-carboxylate;[4-(2-fluoro-3-methoxyphenoxy)phenyl]boronic acid;1-[(3R)-3-[1-[4-(2-fluoro-3-methoxyphenoxy)phenyl]imidazo[1,5-a]pyrazin-3-yl]piperidin-1-yl]prop-2-en-1-one;1-[4-(2-fluoro-3-methoxyphenoxy)phenyl]-3-[(3R)-piperidin-3-yl]imidazo[1,5-a]pyrazine;methane;(3R)-1-phenylmethoxycarbonylpiperidine-3-carboxylic acid;prop-2-enoyl chloride;pyrazine-2-carbonitrile;pyrazin-2-ylmethanamine
PubChem CID158243500
Molecular FormulaC187H208BBrClF4N31O25
Molecular Weight3492.07 g/mol
Exact Mass3488.49
IUPAC Namebenzyl (3R)-3-(1-bromoimidazo[1,5-a]pyrazin-3-yl)piperidine-1-carboxylate;benzyl (3R)-3-[1-[4-(2-fluoro-3-methoxyphenoxy)phenyl]imidazo[1,5-a]pyrazin-3-yl]piperidine-1-carboxylate;benzyl (3R)-3-imidazo[1,5-a]pyrazin-3-ylpiperidine-1-carboxylate;benzyl (3R)-3-(pyrazin-2-ylmethylcarbamoyl)piperidine-1-carboxylate;[4-(2-fluoro-3-methoxyphenoxy)phenyl]boronic acid;1-[(3R)-3-[1-[4-(2-fluoro-3-methoxyphenoxy)phenyl]imidazo[1,5-a]pyrazin-3-yl]piperidin-1-yl]prop-2-en-1-one;1-[4-(2-fluoro-3-methoxyphenoxy)phenyl]-3-[(3R)-piperidin-3-yl]imidazo[1,5-a]pyrazine;methane;(3R)-1-phenylmethoxycarbonylpiperidine-3-carboxylic acid;prop-2-enoyl chloride;pyrazine-2-carbonitrile;pyrazin-2-ylmethanamine
SMILESC.C.C.C.C.C.C.C=CC(=O)Cl.C=CC(=O)N1CCC[C@@H](c2nc(-c3ccc(Oc4cccc(OC)c4F)cc3)c3cnccn23)C1.COc1cccc(Oc2ccc(-c3nc([C@@H]4CCCN(C(=O)OCc5ccccc5)C4)n4ccncc34)cc2)c1F.COc1cccc(Oc2ccc(-c3nc([C@@H]4CCCNC4)n4ccncc34)cc2)c1F.COc1cccc(Oc2ccc(B(O)O)cc2)c1F.N#Cc1cnccn1.NCc1cnccn1.O=C(NCc1cnccn1)[C@@H]1CCCN(C(=O)OCc2ccccc2)C1.O=C(O)[C@@H]1CCCN(C(=O)OCc2ccccc2)C1.O=C(OCc1ccccc1)N1CCC[C@@H](c2nc(Br)c3cnccn23)C1.O=C(OCc1ccccc1)N1CCC[C@@H](c2ncc3cnccn23)C1
InChIInChI=1S/C32H29FN4O4.C27H25FN4O3.C24H23FN4O2.C19H19BrN4O2.C19H22N4O3.C19H20N4O2.C14H17NO4.C13H12BFO4.C5H7N3.C5H3N3.C3H3ClO.7CH4/c1-39-27-10-5-11-28(29(27)33)41-25-14-12-23(13-15-25)30-26-19-34-16-18-37(26)31(35-30)24-9-6-17-36(20-24)32(38)40-21-22-7-3-2-4-8-22;1-3-24(33)31-14-5-6-19(17-31)27-30-26(21-16-29-13-15-32(21)27)18-9-11-20(12-10-18)35-23-8-4-7-22(34-2)25(23)28;1-30-20-5-2-6-21(22(20)25)31-18-9-7-16(8-10-18)23-19-15-27-12-13-29(19)24(28-23)17-4-3-11-26-14-17;20-17-16-11-21-8-10-24(16)18(22-17)15-7-4-9-23(12-15)19(25)26-13-14-5-2-1-3-6-14;24-18(22-12-17-11-20-8-9-21-17)16-7-4-10-23(13-16)19(25)26-14-15-5-2-1-3-6-15;24-19(25-14-15-5-2-1-3-6-15)22-9-4-7-16(13-22)18-21-12-17-11-20-8-10-23(17)18;16-13(17)12-7-4-8-15(9-12)14(18)19-10-11-5-2-1-3-6-11;1-18-11-3-2-4-12(13(11)15)19-10-7-5-9(6-8-10)14(16)17;2*6-3-5-4-7-1-2-8-5;1-2-3(4)5;;;;;;;/h2-5,7-8,10-16,18-19,24H,6,9,17,20-21H2,1H3;3-4,7-13,15-16,19H,1,5-6,14,17H2,2H3;2,5-10,12-13,15,17,26H,3-4,11,14H2,1H3;1-3,5-6,8,10-11,15H,4,7,9,12-13H2;1-3,5-6,8-9,11,16H,4,7,10,12-14H2,(H,22,24);1-3,5-6,8,10-12,16H,4,7,9,13-14H2;1-3,5-6,12H,4,7-10H2,(H,16,17);2-8,16-17H,1H3;1-2,4H,3,6H2;1-2,4H;2H,1H2;7*1H4/t24-;19-;17-;15-;2*16-;12-;;;;;;;;;;;/m1111111.........../s1
InChIKeyGFVOCOLAMMDOPO-GBPBRKKZSA-N
XLogP35.38
TPSA655.91 Ų
H-Bond Donors6
H-Bond Acceptors48
Rotatable Bonds38
Heavy Atoms250
Complexity

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5003492.07
LogP ≤ 535.38
H-Bond Donors ≤ 56
H-Bond Acceptors ≤ 1048

Computed Properties (RDKit)

Structural Alerts{'alert_name': '>_2_ester_groups', 'substructure': 'N/A'}, {'alert_name': 'acid_halide', 'substructure': 'N/A'}, {'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'Michael_acceptor_1', 'substructure': 'N/A'}

Analyze benzyl (3R)-3-(1-bromoimidazo[1,5-a]pyrazin-3-yl)piperidine-1-carboxylate;benzyl (3R)-3-[1-[4-(2-fluoro-3-methoxyphenoxy)phenyl]imidazo[1,5-a]pyrazin-3-yl]piperidine-1-carboxylate;benzyl (3R)-3-imidazo[1,5-a]pyrazin-3-ylpiperidine-1-carboxylate;benzyl (3R)-3-(pyrazin-2-ylmethylcarbamoyl)piperidine-1-carboxylate;[4-(2-fluoro-3-methoxyphenoxy)phenyl]boronic acid;1-[(3R)-3-[1-[4-(2-fluoro-3-methoxyphenoxy)phenyl]imidazo[1,5-a]pyrazin-3-yl]piperidin-1-yl]prop-2-en-1-one;1-[4-(2-fluoro-3-methoxyphenoxy)phenyl]-3-[(3R)-piperidin-3-yl]imidazo[1,5-a]pyrazine;methane;(3R)-1-phenylmethoxycarbonylpiperidine-3-carboxylic acid;prop-2-enoyl chloride;pyrazine-2-carbonitrile;pyrazin-2-ylmethanamine with MolForge

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Related Compounds

Frequently Asked Questions

What is the IUPAC name of benzyl (3R)-3-(1-bromoimidazo[1,5-a]pyrazin-3-yl)piperidine-1-carboxylate;benzyl (3R)-3-[1-[4-(2-fluoro-3-methoxyphenoxy)phenyl]imidazo[1,5-a]pyrazin-3-yl]piperidine-1-carboxylate;benzyl (3R)-3-imidazo[1,5-a]pyrazin-3-ylpiperidine-1-carboxylate;benzyl (3R)-3-(pyrazin-2-ylmethylcarbamoyl)piperidine-1-carboxylate;[4-(2-fluoro-3-methoxyphenoxy)phenyl]boronic acid;1-[(3R)-3-[1-[4-(2-fluoro-3-methoxyphenoxy)phenyl]imidazo[1,5-a]pyrazin-3-yl]piperidin-1-yl]prop-2-en-1-one;1-[4-(2-fluoro-3-methoxyphenoxy)phenyl]-3-[(3R)-piperidin-3-yl]imidazo[1,5-a]pyrazine;methane;(3R)-1-phenylmethoxycarbonylpiperidine-3-carboxylic acid;prop-2-enoyl chloride;pyrazine-2-carbonitrile;pyrazin-2-ylmethanamine?
The IUPAC name of benzyl (3R)-3-(1-bromoimidazo[1,5-a]pyrazin-3-yl)piperidine-1-carboxylate;benzyl (3R)-3-[1-[4-(2-fluoro-3-methoxyphenoxy)phenyl]imidazo[1,5-a]pyrazin-3-yl]piperidine-1-carboxylate;benzyl (3R)-3-imidazo[1,5-a]pyrazin-3-ylpiperidine-1-carboxylate;benzyl (3R)-3-(pyrazin-2-ylmethylcarbamoyl)piperidine-1-carboxylate;[4-(2-fluoro-3-methoxyphenoxy)phenyl]boronic acid;1-[(3R)-3-[1-[4-(2-fluoro-3-methoxyphenoxy)phenyl]imidazo[1,5-a]pyrazin-3-yl]piperidin-1-yl]prop-2-en-1-one;1-[4-(2-fluoro-3-methoxyphenoxy)phenyl]-3-[(3R)-piperidin-3-yl]imidazo[1,5-a]pyrazine;methane;(3R)-1-phenylmethoxycarbonylpiperidine-3-carboxylic acid;prop-2-enoyl chloride;pyrazine-2-carbonitrile;pyrazin-2-ylmethanamine (CID 158243500) is benzyl (3R)-3-(1-bromoimidazo[1,5-a]pyrazin-3-yl)piperidine-1-carboxylate;benzyl (3R)-3-[1-[4-(2-fluoro-3-methoxyphenoxy)phenyl]imidazo[1,5-a]pyrazin-3-yl]piperidine-1-carboxylate;benzyl (3R)-3-imidazo[1,5-a]pyrazin-3-ylpiperidine-1-carboxylate;benzyl (3R)-3-(pyrazin-2-ylmethylcarbamoyl)piperidine-1-carboxylate;[4-(2-fluoro-3-methoxyphenoxy)phenyl]boronic acid;1-[(3R)-3-[1-[4-(2-fluoro-3-methoxyphenoxy)phenyl]imidazo[1,5-a]pyrazin-3-yl]piperidin-1-yl]prop-2-en-1-one;1-[4-(2-fluoro-3-methoxyphenoxy)phenyl]-3-[(3R)-piperidin-3-yl]imidazo[1,5-a]pyrazine;methane;(3R)-1-phenylmethoxycarbonylpiperidine-3-carboxylic acid;prop-2-enoyl chloride;pyrazine-2-carbonitrile;pyrazin-2-ylmethanamine.
What is the SMILES notation for benzyl (3R)-3-(1-bromoimidazo[1,5-a]pyrazin-3-yl)piperidine-1-carboxylate;benzyl (3R)-3-[1-[4-(2-fluoro-3-methoxyphenoxy)phenyl]imidazo[1,5-a]pyrazin-3-yl]piperidine-1-carboxylate;benzyl (3R)-3-imidazo[1,5-a]pyrazin-3-ylpiperidine-1-carboxylate;benzyl (3R)-3-(pyrazin-2-ylmethylcarbamoyl)piperidine-1-carboxylate;[4-(2-fluoro-3-methoxyphenoxy)phenyl]boronic acid;1-[(3R)-3-[1-[4-(2-fluoro-3-methoxyphenoxy)phenyl]imidazo[1,5-a]pyrazin-3-yl]piperidin-1-yl]prop-2-en-1-one;1-[4-(2-fluoro-3-methoxyphenoxy)phenyl]-3-[(3R)-piperidin-3-yl]imidazo[1,5-a]pyrazine;methane;(3R)-1-phenylmethoxycarbonylpiperidine-3-carboxylic acid;prop-2-enoyl chloride;pyrazine-2-carbonitrile;pyrazin-2-ylmethanamine?
The canonical SMILES for benzyl (3R)-3-(1-bromoimidazo[1,5-a]pyrazin-3-yl)piperidine-1-carboxylate;benzyl (3R)-3-[1-[4-(2-fluoro-3-methoxyphenoxy)phenyl]imidazo[1,5-a]pyrazin-3-yl]piperidine-1-carboxylate;benzyl (3R)-3-imidazo[1,5-a]pyrazin-3-ylpiperidine-1-carboxylate;benzyl (3R)-3-(pyrazin-2-ylmethylcarbamoyl)piperidine-1-carboxylate;[4-(2-fluoro-3-methoxyphenoxy)phenyl]boronic acid;1-[(3R)-3-[1-[4-(2-fluoro-3-methoxyphenoxy)phenyl]imidazo[1,5-a]pyrazin-3-yl]piperidin-1-yl]prop-2-en-1-one;1-[4-(2-fluoro-3-methoxyphenoxy)phenyl]-3-[(3R)-piperidin-3-yl]imidazo[1,5-a]pyrazine;methane;(3R)-1-phenylmethoxycarbonylpiperidine-3-carboxylic acid;prop-2-enoyl chloride;pyrazine-2-carbonitrile;pyrazin-2-ylmethanamine is C.C.C.C.C.C.C.C=CC(=O)Cl.C=CC(=O)N1CCC[C@@H](c2nc(-c3ccc(Oc4cccc(OC)c4F)cc3)c3cnccn23)C1.COc1cccc(Oc2ccc(-c3nc([C@@H]4CCCN(C(=O)OCc5ccccc5)C4)n4ccncc34)cc2)c1F.COc1cccc(Oc2ccc(-c3nc([C@@H]4CCCNC4)n4ccncc34)cc2)c1F.COc1cccc(Oc2ccc(B(O)O)cc2)c1F.N#Cc1cnccn1.NCc1cnccn1.O=C(NCc1cnccn1)[C@@H]1CCCN(C(=O)OCc2ccccc2)C1.O=C(O)[C@@H]1CCCN(C(=O)OCc2ccccc2)C1.O=C(OCc1ccccc1)N1CCC[C@@H](c2nc(Br)c3cnccn23)C1.O=C(OCc1ccccc1)N1CCC[C@@H](c2ncc3cnccn23)C1.
What is the InChIKey of benzyl (3R)-3-(1-bromoimidazo[1,5-a]pyrazin-3-yl)piperidine-1-carboxylate;benzyl (3R)-3-[1-[4-(2-fluoro-3-methoxyphenoxy)phenyl]imidazo[1,5-a]pyrazin-3-yl]piperidine-1-carboxylate;benzyl (3R)-3-imidazo[1,5-a]pyrazin-3-ylpiperidine-1-carboxylate;benzyl (3R)-3-(pyrazin-2-ylmethylcarbamoyl)piperidine-1-carboxylate;[4-(2-fluoro-3-methoxyphenoxy)phenyl]boronic acid;1-[(3R)-3-[1-[4-(2-fluoro-3-methoxyphenoxy)phenyl]imidazo[1,5-a]pyrazin-3-yl]piperidin-1-yl]prop-2-en-1-one;1-[4-(2-fluoro-3-methoxyphenoxy)phenyl]-3-[(3R)-piperidin-3-yl]imidazo[1,5-a]pyrazine;methane;(3R)-1-phenylmethoxycarbonylpiperidine-3-carboxylic acid;prop-2-enoyl chloride;pyrazine-2-carbonitrile;pyrazin-2-ylmethanamine?
The InChIKey is GFVOCOLAMMDOPO-GBPBRKKZSA-N. The full InChI is InChI=1S/C32H29FN4O4.C27H25FN4O3.C24H23FN4O2.C19H19BrN4O2.C19H22N4O3.C19H20N4O2.C14H17NO4.C13H12BFO4.C5H7N3.C5H3N3.C3H3ClO.7CH4/c1-39-27-10-5-11-28(29(27)33)41-25-14-12-23(13-15-25)30-26-19-34-16-18-37(26)31(35-30)24-9-6-17-36(20-24)32(38)40-21-22-7-3-2-4-8-22;1-3-24(33)31-14-5-6-19(17-31)27-30-26(21-16-29-13-15-32(21)27)18-9-11-20(12-10-18)35-23-8-4-7-22(34-2)25(23)28;1-30-20-5-2-6-21(22(20)25)31-18-9-7-16(8-10-18)23-19-15-27-12-13-29(19)24(28-23)17-4-3-11-26-14-17;20-17-16-11-21-8-10-24(16)18(22-17)15-7-4-9-23(12-15)19(25)26-13-14-5-2-1-3-6-14;24-18(22-12-17-11-20-8-9-21-17)16-7-4-10-23(13-16)19(25)26-14-15-5-2-1-3-6-15;24-19(25-14-15-5-2-1-3-6-15)22-9-4-7-16(13-22)18-21-12-17-11-20-8-10-23(17)18;16-13(17)12-7-4-8-15(9-12)14(18)19-10-11-5-2-1-3-6-11;1-18-11-3-2-4-12(13(11)15)19-10-7-5-9(6-8-10)14(16)17;2*6-3-5-4-7-1-2-8-5;1-2-3(4)5;;;;;;;/h2-5,7-8,10-16,18-19,24H,6,9,17,20-21H2,1H3;3-4,7-13,15-16,19H,1,5-6,14,17H2,2H3;2,5-10,12-13,15,17,26H,3-4,11,14H2,1H3;1-3,5-6,8,10-11,15H,4,7,9,12-13H2;1-3,5-6,8-9,11,16H,4,7,10,12-14H2,(H,22,24);1-3,5-6,8,10-12,16H,4,7,9,13-14H2;1-3,5-6,12H,4,7-10H2,(H,16,17);2-8,16-17H,1H3;1-2,4H,3,6H2;1-2,4H;2H,1H2;7*1H4/t24-;19-;17-;15-;2*16-;12-;;;;;;;;;;;/m1111111.........../s1.
What are the key properties of benzyl (3R)-3-(1-bromoimidazo[1,5-a]pyrazin-3-yl)piperidine-1-carboxylate;benzyl (3R)-3-[1-[4-(2-fluoro-3-methoxyphenoxy)phenyl]imidazo[1,5-a]pyrazin-3-yl]piperidine-1-carboxylate;benzyl (3R)-3-imidazo[1,5-a]pyrazin-3-ylpiperidine-1-carboxylate;benzyl (3R)-3-(pyrazin-2-ylmethylcarbamoyl)piperidine-1-carboxylate;[4-(2-fluoro-3-methoxyphenoxy)phenyl]boronic acid;1-[(3R)-3-[1-[4-(2-fluoro-3-methoxyphenoxy)phenyl]imidazo[1,5-a]pyrazin-3-yl]piperidin-1-yl]prop-2-en-1-one;1-[4-(2-fluoro-3-methoxyphenoxy)phenyl]-3-[(3R)-piperidin-3-yl]imidazo[1,5-a]pyrazine;methane;(3R)-1-phenylmethoxycarbonylpiperidine-3-carboxylic acid;prop-2-enoyl chloride;pyrazine-2-carbonitrile;pyrazin-2-ylmethanamine?
benzyl (3R)-3-(1-bromoimidazo[1,5-a]pyrazin-3-yl)piperidine-1-carboxylate;benzyl (3R)-3-[1-[4-(2-fluoro-3-methoxyphenoxy)phenyl]imidazo[1,5-a]pyrazin-3-yl]piperidine-1-carboxylate;benzyl (3R)-3-imidazo[1,5-a]pyrazin-3-ylpiperidine-1-carboxylate;benzyl (3R)-3-(pyrazin-2-ylmethylcarbamoyl)piperidine-1-carboxylate;[4-(2-fluoro-3-methoxyphenoxy)phenyl]boronic acid;1-[(3R)-3-[1-[4-(2-fluoro-3-methoxyphenoxy)phenyl]imidazo[1,5-a]pyrazin-3-yl]piperidin-1-yl]prop-2-en-1-one;1-[4-(2-fluoro-3-methoxyphenoxy)phenyl]-3-[(3R)-piperidin-3-yl]imidazo[1,5-a]pyrazine;methane;(3R)-1-phenylmethoxycarbonylpiperidine-3-carboxylic acid;prop-2-enoyl chloride;pyrazine-2-carbonitrile;pyrazin-2-ylmethanamine has a molecular weight of 3492.07 g/mol, XLogP of 35.38, 38 rotatable bonds, 6 hydrogen bond donors, and 48 hydrogen bond acceptors.
Where does this data come from?
All data for benzyl (3R)-3-(1-bromoimidazo[1,5-a]pyrazin-3-yl)piperidine-1-carboxylate;benzyl (3R)-3-[1-[4-(2-fluoro-3-methoxyphenoxy)phenyl]imidazo[1,5-a]pyrazin-3-yl]piperidine-1-carboxylate;benzyl (3R)-3-imidazo[1,5-a]pyrazin-3-ylpiperidine-1-carboxylate;benzyl (3R)-3-(pyrazin-2-ylmethylcarbamoyl)piperidine-1-carboxylate;[4-(2-fluoro-3-methoxyphenoxy)phenyl]boronic acid;1-[(3R)-3-[1-[4-(2-fluoro-3-methoxyphenoxy)phenyl]imidazo[1,5-a]pyrazin-3-yl]piperidin-1-yl]prop-2-en-1-one;1-[4-(2-fluoro-3-methoxyphenoxy)phenyl]-3-[(3R)-piperidin-3-yl]imidazo[1,5-a]pyrazine;methane;(3R)-1-phenylmethoxycarbonylpiperidine-3-carboxylic acid;prop-2-enoyl chloride;pyrazine-2-carbonitrile;pyrazin-2-ylmethanamine is sourced from PubChem (CID 158243500), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).