3-bromo-5-chloro-2-ethyl-7-methylpyrazolo[1,5-a]pyrimidine;tert-butyl (2R)-4-(3-amino-2-ethyl-7-methylpyrazolo[1,5-a]pyrimidin-5-yl)-2-methylpiperazine-1-carboxylate;tert-butyl (2R)-4-[3-(benzhydrylideneamino)-2-ethyl-7-methylpyrazolo[1,5-a]pyrimidin-5-yl]-2-methylpiperazine-1-carboxylate;tert-butyl (2R)-4-(3-bromo-2-ethyl-7-methylpyrazolo[1,5-a]pyrimidin-5-yl)-2-methylpiperazine-1-carboxylate;tert-butyl (2R)-2-methylpiperazine-1-carboxylate;2-chloro-4-(4-fluorophenyl)-1,3-thiazole-5-carbonitrile;diphenylmethanimine

C112H140Br2Cl2FN25O8S — CID 158759264

IUPAC3-bromo-5-chloro-2-ethyl-7-methylpyrazolo[1,5-a]pyrimidine;tert-butyl (2R)-4-(3-amino-2-ethyl-7-methylpyrazolo[1,5-a]pyrimidin-5-yl)-2-methylpiperazine-1-carboxylate;tert-butyl (2R)-4-[3-(benzhydrylideneamino)-2-ethyl-7-methylpyrazolo[1,5-a]pyrimidin-5-yl]-2-methylpiperazine-1-carboxylate;tert-butyl (2R)-4-(3-bromo-2-ethyl-7-methylpyrazolo[1,5-a]pyrimidin-5-yl)-2-methylpiperazine-1-carboxylate;tert-butyl (2R)-2-methylpiperazine-1-carboxylate;2-chloro-4-(4-fluorophenyl)-1,3-thiazole-5-carbonitrile;diphenylmethanimine
SMILESCCc1nn2c(C)cc(Cl)nc2c1Br.CCc1nn2c(C)cc(N3CCN(C(=O)OC(C)(C)C)[C@H](C)C3)nc2c1Br.CCc1nn2c(C)cc(N3CCN(C(=O)OC(C)(C)C)[C@H](C)C3)nc2c1N.CCc1nn2c(C)cc(N3CCN(C(=O)OC(C)(C)C)[C@H](C)C3)nc2c1N=C(c1ccccc1)c1ccccc1.C[C@@H]1CNCCN1C(=O)OC(C)(C)C.N#Cc1sc(Cl)nc1-c1ccc(F)cc1.[H]N=C(c1ccccc1)c1ccccc1
InChIInChI=1S/C32H38N6O2.C19H28BrN5O2.C19H30N6O2.C13H11N.C10H4ClFN2S.C10H20N2O2.C9H9BrClN3/c1-7-26-29(34-28(24-14-10-8-11-15-24)25-16-12-9-13-17-25)30-33-27(20-22(2)38(30)35-26)36-18-19-37(23(3)21-36)31(39)40-32(4,5)6;2*1-7-14-16(20)17-21-15(10-12(2)25(17)22-14)23-8-9-24(13(3)11-23)18(26)27-19(4,5)6;14-13(11-7-3-1-4-8-11)12-9-5-2-6-10-12;11-10-14-9(8(5-13)15-10)6-1-3-7(12)4-2-6;1-8-7-11-5-6-12(8)9(13)14-10(2,3)4;1-3-6-8(10)9-12-7(11)4-5(2)14(9)13-6/h8-17,20,23H,7,18-19,21H2,1-6H3;10,13H,7-9,11H2,1-6H3;10,13H,7-9,11,20H2,1-6H3;1-10,14H;1-4H;8,11H,5-7H2,1-4H3;4H,3H2,1-2H3/t23-;2*13-;;;8-;/m111..1./s1
InChIKeyIOLLSHILRBOARF-OYUPDJDBSA-N
MW2246.30 g/mol
LogP23.46
Rot. Bonds13

About 3-bromo-5-chloro-2-ethyl-7-methylpyrazolo[1,5-a]pyrimidine;tert-butyl (2R)-4-(3-amino-2-ethyl-7-methylpyrazolo[1,5-a]pyrimidin-5-yl)-2-methylpiperazine-1-carboxylate;tert-butyl (2R)-4-[3-(benzhydrylideneamino)-2-ethyl-7-methylpyrazolo[1,5-a]pyrimidin-5-yl]-2-methylpiperazine-1-carboxylate;tert-butyl (2R)-4-(3-bromo-2-ethyl-7-methylpyrazolo[1,5-a]pyrimidin-5-yl)-2-methylpiperazine-1-carboxylate;tert-butyl (2R)-2-methylpiperazine-1-carboxylate;2-chloro-4-(4-fluorophenyl)-1,3-thiazole-5-carbonitrile;diphenylmethanimine

3-bromo-5-chloro-2-ethyl-7-methylpyrazolo[1,5-a]pyrimidine;tert-butyl (2R)-4-(3-amino-2-ethyl-7-methylpyrazolo[1,5-a]pyrimidin-5-yl)-2-methylpiperazine-1-carboxylate;tert-butyl (2R)-4-[3-(benzhydrylideneamino)-2-ethyl-7-methylpyrazolo[1,5-a]pyrimidin-5-yl]-2-methylpiperazine-1-carboxylate;tert-butyl (2R)-4-(3-bromo-2-ethyl-7-methylpyrazolo[1,5-a]pyrimidin-5-yl)-2-methylpiperazine-1-carboxylate;tert-butyl (2R)-2-methylpiperazine-1-carboxylate;2-chloro-4-(4-fluorophenyl)-1,3-thiazole-5-carbonitrile;diphenylmethanimine (PubChem CID 158759264) has the molecular formula C112H140Br2Cl2FN25O8S and a molecular weight of 2246.30 g/mol. Its IUPAC name is 3-bromo-5-chloro-2-ethyl-7-methylpyrazolo[1,5-a]pyrimidine;tert-butyl (2R)-4-(3-amino-2-ethyl-7-methylpyrazolo[1,5-a]pyrimidin-5-yl)-2-methylpiperazine-1-carboxylate;tert-butyl (2R)-4-[3-(benzhydrylideneamino)-2-ethyl-7-methylpyrazolo[1,5-a]pyrimidin-5-yl]-2-methylpiperazine-1-carboxylate;tert-butyl (2R)-4-(3-bromo-2-ethyl-7-methylpyrazolo[1,5-a]pyrimidin-5-yl)-2-methylpiperazine-1-carboxylate;tert-butyl (2R)-2-methylpiperazine-1-carboxylate;2-chloro-4-(4-fluorophenyl)-1,3-thiazole-5-carbonitrile;diphenylmethanimine.

Molecular Properties

Compound Name3-bromo-5-chloro-2-ethyl-7-methylpyrazolo[1,5-a]pyrimidine;tert-butyl (2R)-4-(3-amino-2-ethyl-7-methylpyrazolo[1,5-a]pyrimidin-5-yl)-2-methylpiperazine-1-carboxylate;tert-butyl (2R)-4-[3-(benzhydrylideneamino)-2-ethyl-7-methylpyrazolo[1,5-a]pyrimidin-5-yl]-2-methylpiperazine-1-carboxylate;tert-butyl (2R)-4-(3-bromo-2-ethyl-7-methylpyrazolo[1,5-a]pyrimidin-5-yl)-2-methylpiperazine-1-carboxylate;tert-butyl (2R)-2-methylpiperazine-1-carboxylate;2-chloro-4-(4-fluorophenyl)-1,3-thiazole-5-carbonitrile;diphenylmethanimine
PubChem CID158759264
Molecular FormulaC112H140Br2Cl2FN25O8S
Molecular Weight2246.30 g/mol
Exact Mass2241.88
IUPAC Name3-bromo-5-chloro-2-ethyl-7-methylpyrazolo[1,5-a]pyrimidine;tert-butyl (2R)-4-(3-amino-2-ethyl-7-methylpyrazolo[1,5-a]pyrimidin-5-yl)-2-methylpiperazine-1-carboxylate;tert-butyl (2R)-4-[3-(benzhydrylideneamino)-2-ethyl-7-methylpyrazolo[1,5-a]pyrimidin-5-yl]-2-methylpiperazine-1-carboxylate;tert-butyl (2R)-4-(3-bromo-2-ethyl-7-methylpyrazolo[1,5-a]pyrimidin-5-yl)-2-methylpiperazine-1-carboxylate;tert-butyl (2R)-2-methylpiperazine-1-carboxylate;2-chloro-4-(4-fluorophenyl)-1,3-thiazole-5-carbonitrile;diphenylmethanimine
SMILESCCc1nn2c(C)cc(Cl)nc2c1Br.CCc1nn2c(C)cc(N3CCN(C(=O)OC(C)(C)C)[C@H](C)C3)nc2c1Br.CCc1nn2c(C)cc(N3CCN(C(=O)OC(C)(C)C)[C@H](C)C3)nc2c1N.CCc1nn2c(C)cc(N3CCN(C(=O)OC(C)(C)C)[C@H](C)C3)nc2c1N=C(c1ccccc1)c1ccccc1.C[C@@H]1CNCCN1C(=O)OC(C)(C)C.N#Cc1sc(Cl)nc1-c1ccc(F)cc1.[H]N=C(c1ccccc1)c1ccccc1
InChIInChI=1S/C32H38N6O2.C19H28BrN5O2.C19H30N6O2.C13H11N.C10H4ClFN2S.C10H20N2O2.C9H9BrClN3/c1-7-26-29(34-28(24-14-10-8-11-15-24)25-16-12-9-13-17-25)30-33-27(20-22(2)38(30)35-26)36-18-19-37(23(3)21-36)31(39)40-32(4,5)6;2*1-7-14-16(20)17-21-15(10-12(2)25(17)22-14)23-8-9-24(13(3)11-23)18(26)27-19(4,5)6;14-13(11-7-3-1-4-8-11)12-9-5-2-6-10-12;11-10-14-9(8(5-13)15-10)6-1-3-7(12)4-2-6;1-8-7-11-5-6-12(8)9(13)14-10(2,3)4;1-3-6-8(10)9-12-7(11)4-5(2)14(9)13-6/h8-17,20,23H,7,18-19,21H2,1-6H3;10,13H,7-9,11H2,1-6H3;10,13H,7-9,11,20H2,1-6H3;1-10,14H;1-4H;8,11H,5-7H2,1-4H3;4H,3H2,1-2H3/t23-;2*13-;;;8-;/m111..1./s1
InChIKeyIOLLSHILRBOARF-OYUPDJDBSA-N
XLogP23.46
TPSA359.58 Ų
H-Bond Donors3
H-Bond Acceptors30
Rotatable Bonds13
Heavy Atoms151
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002246.30
LogP ≤ 523.46
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 1030

Computed Properties (RDKit)

Structural Alerts{'alert_name': '>_2_ester_groups', 'substructure': 'N/A'}, {'alert_name': 'imine_1', 'substructure': 'N/A'}

Analyze 3-bromo-5-chloro-2-ethyl-7-methylpyrazolo[1,5-a]pyrimidine;tert-butyl (2R)-4-(3-amino-2-ethyl-7-methylpyrazolo[1,5-a]pyrimidin-5-yl)-2-methylpiperazine-1-carboxylate;tert-butyl (2R)-4-[3-(benzhydrylideneamino)-2-ethyl-7-methylpyrazolo[1,5-a]pyrimidin-5-yl]-2-methylpiperazine-1-carboxylate;tert-butyl (2R)-4-(3-bromo-2-ethyl-7-methylpyrazolo[1,5-a]pyrimidin-5-yl)-2-methylpiperazine-1-carboxylate;tert-butyl (2R)-2-methylpiperazine-1-carboxylate;2-chloro-4-(4-fluorophenyl)-1,3-thiazole-5-carbonitrile;diphenylmethanimine with MolForge

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Launch Full Analysis

Related Compounds

3-bromo-5-chloro-2-ethyl-7-methylpyrazolo[1,5-a]pyrimidine;3-bromo-2-ethyl-7-methyl-5-[(2R)-2-methylpiperidin-1-yl]pyrazolo[1,5-a]pyrimidine;tert-butyl (3R)-4-(3-amino-2-ethyl-7-methylpyrazolo[1,5-a]pyrimidin-5-yl)-3-methylpiperazine-1-carboxylate;tert-butyl (3R)-4-[3-(benzhydrylideneamino)-2-ethyl-7-methylpyrazolo[1,5-a]pyrimidin-5-yl]-3-methylpiperazine-1-carboxylate;diphenylmethanimine;(2R)-2-methylpiperidine
CID 158547938
3-bromo-5-chloro-2-ethyl-7-methylpyrazolo[1,5-a]pyrimidine;3-bromo-2-ethyl-7-methyl-5-[(2S)-2-methylpiperidin-1-yl]pyrazolo[1,5-a]pyrimidine;tert-butyl (3S)-4-(3-amino-2-ethyl-7-methylpyrazolo[1,5-a]pyrimidin-5-yl)-3-methylpiperazine-1-carboxylate;tert-butyl (3S)-4-[3-(benzhydrylideneamino)-2-ethyl-7-methylpyrazolo[1,5-a]pyrimidin-5-yl]-3-methylpiperazine-1-carboxylate;diphenylmethanimine;(2S)-2-methylpiperidine
CID 158547940
3-bromo-5-chloro-2-ethyl-7-methylpyrazolo[1,5-a]pyrimidine;tert-butyl (2S)-4-(3-amino-2-ethyl-7-methylpyrazolo[1,5-a]pyrimidin-5-yl)-2-methylpiperazine-1-carboxylate;tert-butyl (2S)-4-[3-(benzhydrylideneamino)-2-ethyl-7-methylpyrazolo[1,5-a]pyrimidin-5-yl]-2-methylpiperazine-1-carboxylate;tert-butyl (2S)-4-(3-bromo-2-ethyl-7-methylpyrazolo[1,5-a]pyrimidin-5-yl)-2-methylpiperazine-1-carboxylate;tert-butyl (2S)-2-methylpiperazine-1-carboxylate;2-chloro-4-(4-fluorophenyl)-1,3-thiazole-5-carbonitrile;diphenylmethanimine
CID 158759265
3-bromo-5-chloro-2-ethylpyrazolo[1,5-a]pyrimidine;3-bromo-2-ethyl-5-piperidin-1-ylpyrazolo[1,5-a]pyrimidine;tert-butyl 4-(3-amino-2-ethylpyrazolo[1,5-a]pyrimidin-5-yl)piperazine-1-carboxylate;tert-butyl 4-[3-(benzhydrylideneamino)-2-ethylpyrazolo[1,5-a]pyrimidin-5-yl]piperazine-1-carboxylate;5-chloro-2-ethylpyrazolo[1,5-a]pyrimidine;2-chloro-4-(4-fluorophenyl)-1,3-thiazole-5-carbonitrile;5,7-dichloro-2-ethyl-4,5-dihydropyrazolo[1,5-a]pyrimidine;dimethyl propanedioate;diphenylmethanimine;5-ethyl-1H-pyrazol-3-amine;2-ethyl-4H-pyrazolo[1,5-a]pyridine-5,7-dione;piperidine
CID 158916003
2-Bromoacetyl bromide;2-bromo-1-(3-hydroxy-3-methylazetidin-1-yl)ethanone;tert-butyl 4-(3-amino-2-ethylpyrazolo[1,5-a]pyrimidin-5-yl)piperazine-1-carboxylate;tert-butyl 4-[3-[[5-cyano-4-(4-fluorophenyl)-1,3-thiazol-2-yl]amino]-2-ethylpyrazolo[1,5-a]pyrimidin-5-yl]piperazine-1-carboxylate;tert-butyl 4-[3-[[5-cyano-4-(4-fluorophenyl)-1,3-thiazol-2-yl]-methylamino]-2-ethylpyrazolo[1,5-a]pyrimidin-5-yl]piperazine-1-carboxylate;2-chloro-4-(4-fluorophenyl)-1,3-thiazole-5-carbonitrile;2-[(2-ethyl-5-piperazin-1-ylpyrazolo[1,5-a]pyrimidin-3-yl)-methylamino]-4-(4-fluorophenyl)-1,3-thiazole-5-carbonitrile;3-hydroxy-3-methylazetidine-1-carbonyl bromide;methane;3-methylazetidin-3-ol;hydrochloride
CID 160763060
tert-butyl N-(5-bromo-2-ethylpyrazolo[1,5-a]pyridin-3-yl)-N-methylcarbamate;tert-butyl N-(7-deuterio-2-ethyl-5-piperidin-1-ylpyrazolo[1,5-a]pyridin-3-yl)-N-methylcarbamate;tert-butyl N-(2-ethyl-5-piperidin-1-ylpyrazolo[1,5-a]pyridin-3-yl)-N-methylcarbamate;7-deuterio-2-ethyl-N-methyl-5-piperazin-1-ylpyrazolo[1,5-a]pyridin-3-amine;7-deuterio-2-ethyl-N-methyl-5-piperidin-1-ylpyrazolo[1,5-a]pyridin-3-amine;2-[(7-deuterio-2-ethyl-5-piperidin-1-ylpyrazolo[1,5-a]pyridin-3-yl)-methylamino]-4-(4-fluorophenyl)-1,3-thiazole-5-carbonitrile;piperidine
CID 161003630
3-bromo-5-chloro-2-ethyl-7-methylpyrazolo[1,5-a]pyrimidine;3-bromo-2-ethyl-7-methyl-5-piperidin-1-ylpyrazolo[1,5-a]pyrimidine;tert-butyl 4-(3-amino-2-ethyl-7-methylpyrazolo[1,5-a]pyrimidin-5-yl)piperazine-1-carboxylate;tert-butyl 4-[3-(benzhydrylideneamino)-2-ethyl-7-methylpyrazolo[1,5-a]pyrimidin-5-yl]piperazine-1-carboxylate;5-chloro-2-ethyl-7-methylpyrazolo[1,5-a]pyrimidine;2-chloro-4-(4-fluorophenyl)-1,3-thiazole-5-carbonitrile;diphenylmethanimine;2-ethyl-7-methyl-4H-pyrazolo[1,5-a]pyridin-5-one;5-ethyl-1H-pyrazol-3-amine;methyl 3-oxobutanoate;piperidine
CID 161966231

Frequently Asked Questions

What is the IUPAC name of 3-bromo-5-chloro-2-ethyl-7-methylpyrazolo[1,5-a]pyrimidine;tert-butyl (2R)-4-(3-amino-2-ethyl-7-methylpyrazolo[1,5-a]pyrimidin-5-yl)-2-methylpiperazine-1-carboxylate;tert-butyl (2R)-4-[3-(benzhydrylideneamino)-2-ethyl-7-methylpyrazolo[1,5-a]pyrimidin-5-yl]-2-methylpiperazine-1-carboxylate;tert-butyl (2R)-4-(3-bromo-2-ethyl-7-methylpyrazolo[1,5-a]pyrimidin-5-yl)-2-methylpiperazine-1-carboxylate;tert-butyl (2R)-2-methylpiperazine-1-carboxylate;2-chloro-4-(4-fluorophenyl)-1,3-thiazole-5-carbonitrile;diphenylmethanimine?
The IUPAC name of 3-bromo-5-chloro-2-ethyl-7-methylpyrazolo[1,5-a]pyrimidine;tert-butyl (2R)-4-(3-amino-2-ethyl-7-methylpyrazolo[1,5-a]pyrimidin-5-yl)-2-methylpiperazine-1-carboxylate;tert-butyl (2R)-4-[3-(benzhydrylideneamino)-2-ethyl-7-methylpyrazolo[1,5-a]pyrimidin-5-yl]-2-methylpiperazine-1-carboxylate;tert-butyl (2R)-4-(3-bromo-2-ethyl-7-methylpyrazolo[1,5-a]pyrimidin-5-yl)-2-methylpiperazine-1-carboxylate;tert-butyl (2R)-2-methylpiperazine-1-carboxylate;2-chloro-4-(4-fluorophenyl)-1,3-thiazole-5-carbonitrile;diphenylmethanimine (CID 158759264) is 3-bromo-5-chloro-2-ethyl-7-methylpyrazolo[1,5-a]pyrimidine;tert-butyl (2R)-4-(3-amino-2-ethyl-7-methylpyrazolo[1,5-a]pyrimidin-5-yl)-2-methylpiperazine-1-carboxylate;tert-butyl (2R)-4-[3-(benzhydrylideneamino)-2-ethyl-7-methylpyrazolo[1,5-a]pyrimidin-5-yl]-2-methylpiperazine-1-carboxylate;tert-butyl (2R)-4-(3-bromo-2-ethyl-7-methylpyrazolo[1,5-a]pyrimidin-5-yl)-2-methylpiperazine-1-carboxylate;tert-butyl (2R)-2-methylpiperazine-1-carboxylate;2-chloro-4-(4-fluorophenyl)-1,3-thiazole-5-carbonitrile;diphenylmethanimine.
What is the SMILES notation for 3-bromo-5-chloro-2-ethyl-7-methylpyrazolo[1,5-a]pyrimidine;tert-butyl (2R)-4-(3-amino-2-ethyl-7-methylpyrazolo[1,5-a]pyrimidin-5-yl)-2-methylpiperazine-1-carboxylate;tert-butyl (2R)-4-[3-(benzhydrylideneamino)-2-ethyl-7-methylpyrazolo[1,5-a]pyrimidin-5-yl]-2-methylpiperazine-1-carboxylate;tert-butyl (2R)-4-(3-bromo-2-ethyl-7-methylpyrazolo[1,5-a]pyrimidin-5-yl)-2-methylpiperazine-1-carboxylate;tert-butyl (2R)-2-methylpiperazine-1-carboxylate;2-chloro-4-(4-fluorophenyl)-1,3-thiazole-5-carbonitrile;diphenylmethanimine?
The canonical SMILES for 3-bromo-5-chloro-2-ethyl-7-methylpyrazolo[1,5-a]pyrimidine;tert-butyl (2R)-4-(3-amino-2-ethyl-7-methylpyrazolo[1,5-a]pyrimidin-5-yl)-2-methylpiperazine-1-carboxylate;tert-butyl (2R)-4-[3-(benzhydrylideneamino)-2-ethyl-7-methylpyrazolo[1,5-a]pyrimidin-5-yl]-2-methylpiperazine-1-carboxylate;tert-butyl (2R)-4-(3-bromo-2-ethyl-7-methylpyrazolo[1,5-a]pyrimidin-5-yl)-2-methylpiperazine-1-carboxylate;tert-butyl (2R)-2-methylpiperazine-1-carboxylate;2-chloro-4-(4-fluorophenyl)-1,3-thiazole-5-carbonitrile;diphenylmethanimine is CCc1nn2c(C)cc(Cl)nc2c1Br.CCc1nn2c(C)cc(N3CCN(C(=O)OC(C)(C)C)[C@H](C)C3)nc2c1Br.CCc1nn2c(C)cc(N3CCN(C(=O)OC(C)(C)C)[C@H](C)C3)nc2c1N.CCc1nn2c(C)cc(N3CCN(C(=O)OC(C)(C)C)[C@H](C)C3)nc2c1N=C(c1ccccc1)c1ccccc1.C[C@@H]1CNCCN1C(=O)OC(C)(C)C.N#Cc1sc(Cl)nc1-c1ccc(F)cc1.[H]N=C(c1ccccc1)c1ccccc1.
What is the InChIKey of 3-bromo-5-chloro-2-ethyl-7-methylpyrazolo[1,5-a]pyrimidine;tert-butyl (2R)-4-(3-amino-2-ethyl-7-methylpyrazolo[1,5-a]pyrimidin-5-yl)-2-methylpiperazine-1-carboxylate;tert-butyl (2R)-4-[3-(benzhydrylideneamino)-2-ethyl-7-methylpyrazolo[1,5-a]pyrimidin-5-yl]-2-methylpiperazine-1-carboxylate;tert-butyl (2R)-4-(3-bromo-2-ethyl-7-methylpyrazolo[1,5-a]pyrimidin-5-yl)-2-methylpiperazine-1-carboxylate;tert-butyl (2R)-2-methylpiperazine-1-carboxylate;2-chloro-4-(4-fluorophenyl)-1,3-thiazole-5-carbonitrile;diphenylmethanimine?
The InChIKey is IOLLSHILRBOARF-OYUPDJDBSA-N. The full InChI is InChI=1S/C32H38N6O2.C19H28BrN5O2.C19H30N6O2.C13H11N.C10H4ClFN2S.C10H20N2O2.C9H9BrClN3/c1-7-26-29(34-28(24-14-10-8-11-15-24)25-16-12-9-13-17-25)30-33-27(20-22(2)38(30)35-26)36-18-19-37(23(3)21-36)31(39)40-32(4,5)6;2*1-7-14-16(20)17-21-15(10-12(2)25(17)22-14)23-8-9-24(13(3)11-23)18(26)27-19(4,5)6;14-13(11-7-3-1-4-8-11)12-9-5-2-6-10-12;11-10-14-9(8(5-13)15-10)6-1-3-7(12)4-2-6;1-8-7-11-5-6-12(8)9(13)14-10(2,3)4;1-3-6-8(10)9-12-7(11)4-5(2)14(9)13-6/h8-17,20,23H,7,18-19,21H2,1-6H3;10,13H,7-9,11H2,1-6H3;10,13H,7-9,11,20H2,1-6H3;1-10,14H;1-4H;8,11H,5-7H2,1-4H3;4H,3H2,1-2H3/t23-;2*13-;;;8-;/m111..1./s1.
What are the key properties of 3-bromo-5-chloro-2-ethyl-7-methylpyrazolo[1,5-a]pyrimidine;tert-butyl (2R)-4-(3-amino-2-ethyl-7-methylpyrazolo[1,5-a]pyrimidin-5-yl)-2-methylpiperazine-1-carboxylate;tert-butyl (2R)-4-[3-(benzhydrylideneamino)-2-ethyl-7-methylpyrazolo[1,5-a]pyrimidin-5-yl]-2-methylpiperazine-1-carboxylate;tert-butyl (2R)-4-(3-bromo-2-ethyl-7-methylpyrazolo[1,5-a]pyrimidin-5-yl)-2-methylpiperazine-1-carboxylate;tert-butyl (2R)-2-methylpiperazine-1-carboxylate;2-chloro-4-(4-fluorophenyl)-1,3-thiazole-5-carbonitrile;diphenylmethanimine?
3-bromo-5-chloro-2-ethyl-7-methylpyrazolo[1,5-a]pyrimidine;tert-butyl (2R)-4-(3-amino-2-ethyl-7-methylpyrazolo[1,5-a]pyrimidin-5-yl)-2-methylpiperazine-1-carboxylate;tert-butyl (2R)-4-[3-(benzhydrylideneamino)-2-ethyl-7-methylpyrazolo[1,5-a]pyrimidin-5-yl]-2-methylpiperazine-1-carboxylate;tert-butyl (2R)-4-(3-bromo-2-ethyl-7-methylpyrazolo[1,5-a]pyrimidin-5-yl)-2-methylpiperazine-1-carboxylate;tert-butyl (2R)-2-methylpiperazine-1-carboxylate;2-chloro-4-(4-fluorophenyl)-1,3-thiazole-5-carbonitrile;diphenylmethanimine has a molecular weight of 2246.30 g/mol, XLogP of 23.46, 13 rotatable bonds, 3 hydrogen bond donors, and 30 hydrogen bond acceptors.
Where does this data come from?
All data for 3-bromo-5-chloro-2-ethyl-7-methylpyrazolo[1,5-a]pyrimidine;tert-butyl (2R)-4-(3-amino-2-ethyl-7-methylpyrazolo[1,5-a]pyrimidin-5-yl)-2-methylpiperazine-1-carboxylate;tert-butyl (2R)-4-[3-(benzhydrylideneamino)-2-ethyl-7-methylpyrazolo[1,5-a]pyrimidin-5-yl]-2-methylpiperazine-1-carboxylate;tert-butyl (2R)-4-(3-bromo-2-ethyl-7-methylpyrazolo[1,5-a]pyrimidin-5-yl)-2-methylpiperazine-1-carboxylate;tert-butyl (2R)-2-methylpiperazine-1-carboxylate;2-chloro-4-(4-fluorophenyl)-1,3-thiazole-5-carbonitrile;diphenylmethanimine is sourced from PubChem (CID 158759264), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).