2-(bromomethyl)-1-fluoro-4-(trifluoromethyl)benzene;tert-butyl 4-cyanocyclohexane-1-carboxylate;tert-butyl 4-cyano-4-[[2-fluoro-5-(trifluoromethyl)phenyl]methyl]piperidine-1-carboxylate;4-[[2-fluoro-5-(trifluoromethyl)phenyl]methyl]piperidine-4-carbonitrile;4-[[2-fluoro-5-(trifluoromethyl)phenyl]methyl]-1-(2-pyrimidin-4-ylpyridine-3-carbonyl)piperidine-4-carbonitrile;methane;2-pyrimidin-4-ylpyridine-3-carboxylic acid;hydrochloride

C93H111BrClF16N13O7 — CID 167537246

IUPAC2-(bromomethyl)-1-fluoro-4-(trifluoromethyl)benzene;tert-butyl 4-cyanocyclohexane-1-carboxylate;tert-butyl 4-cyano-4-[[2-fluoro-5-(trifluoromethyl)phenyl]methyl]piperidine-1-carboxylate;4-[[2-fluoro-5-(trifluoromethyl)phenyl]methyl]piperidine-4-carbonitrile;4-[[2-fluoro-5-(trifluoromethyl)phenyl]methyl]-1-(2-pyrimidin-4-ylpyridine-3-carbonyl)piperidine-4-carbonitrile;methane;2-pyrimidin-4-ylpyridine-3-carboxylic acid;hydrochloride
SMILESC.C.C.C.C.C.CC(C)(C)OC(=O)C1CCC(C#N)CC1.CC(C)(C)OC(=O)N1CCC(C#N)(Cc2cc(C(F)(F)F)ccc2F)CC1.Cl.Fc1ccc(C(F)(F)F)cc1CBr.N#CC1(Cc2cc(C(F)(F)F)ccc2F)CCN(C(=O)c2cccnc2-c2ccncn2)CC1.N#CC1(Cc2cc(C(F)(F)F)ccc2F)CCNCC1.O=C(O)c1cccnc1-c1ccncn1
InChIInChI=1S/C24H19F4N5O.C19H22F4N2O2.C14H14F4N2.C12H19NO2.C10H7N3O2.C8H5BrF4.6CH4.ClH/c25-19-4-3-17(24(26,27)28)12-16(19)13-23(14-29)6-10-33(11-7-23)22(34)18-2-1-8-31-21(18)20-5-9-30-15-32-20;1-17(2,3)27-16(26)25-8-6-18(12-24,7-9-25)11-13-10-14(19(21,22)23)4-5-15(13)20;15-12-2-1-11(14(16,17)18)7-10(12)8-13(9-19)3-5-20-6-4-13;1-12(2,3)15-11(14)10-6-4-9(8-13)5-7-10;14-10(15)7-2-1-4-12-9(7)8-3-5-11-6-13-8;9-4-5-3-6(8(11,12)13)1-2-7(5)10;;;;;;;/h1-5,8-9,12,15H,6-7,10-11,13H2;4-5,10H,6-9,11H2,1-3H3;1-2,7,20H,3-6,8H2;9-10H,4-7H2,1-3H3;1-6H,(H,14,15);1-3H,4H2;6*1H4;1H
InChIKeyPBXRCOKHYNKJIQ-UHFFFAOYSA-N
MW1942.32 g/mol
LogP24.77
Rot. Bonds12

About 2-(bromomethyl)-1-fluoro-4-(trifluoromethyl)benzene;tert-butyl 4-cyanocyclohexane-1-carboxylate;tert-butyl 4-cyano-4-[[2-fluoro-5-(trifluoromethyl)phenyl]methyl]piperidine-1-carboxylate;4-[[2-fluoro-5-(trifluoromethyl)phenyl]methyl]piperidine-4-carbonitrile;4-[[2-fluoro-5-(trifluoromethyl)phenyl]methyl]-1-(2-pyrimidin-4-ylpyridine-3-carbonyl)piperidine-4-carbonitrile;methane;2-pyrimidin-4-ylpyridine-3-carboxylic acid;hydrochloride

2-(bromomethyl)-1-fluoro-4-(trifluoromethyl)benzene;tert-butyl 4-cyanocyclohexane-1-carboxylate;tert-butyl 4-cyano-4-[[2-fluoro-5-(trifluoromethyl)phenyl]methyl]piperidine-1-carboxylate;4-[[2-fluoro-5-(trifluoromethyl)phenyl]methyl]piperidine-4-carbonitrile;4-[[2-fluoro-5-(trifluoromethyl)phenyl]methyl]-1-(2-pyrimidin-4-ylpyridine-3-carbonyl)piperidine-4-carbonitrile;methane;2-pyrimidin-4-ylpyridine-3-carboxylic acid;hydrochloride (PubChem CID 167537246) has the molecular formula C93H111BrClF16N13O7 and a molecular weight of 1942.32 g/mol. Its IUPAC name is 2-(bromomethyl)-1-fluoro-4-(trifluoromethyl)benzene;tert-butyl 4-cyanocyclohexane-1-carboxylate;tert-butyl 4-cyano-4-[[2-fluoro-5-(trifluoromethyl)phenyl]methyl]piperidine-1-carboxylate;4-[[2-fluoro-5-(trifluoromethyl)phenyl]methyl]piperidine-4-carbonitrile;4-[[2-fluoro-5-(trifluoromethyl)phenyl]methyl]-1-(2-pyrimidin-4-ylpyridine-3-carbonyl)piperidine-4-carbonitrile;methane;2-pyrimidin-4-ylpyridine-3-carboxylic acid;hydrochloride.

Molecular Properties

Compound Name2-(bromomethyl)-1-fluoro-4-(trifluoromethyl)benzene;tert-butyl 4-cyanocyclohexane-1-carboxylate;tert-butyl 4-cyano-4-[[2-fluoro-5-(trifluoromethyl)phenyl]methyl]piperidine-1-carboxylate;4-[[2-fluoro-5-(trifluoromethyl)phenyl]methyl]piperidine-4-carbonitrile;4-[[2-fluoro-5-(trifluoromethyl)phenyl]methyl]-1-(2-pyrimidin-4-ylpyridine-3-carbonyl)piperidine-4-carbonitrile;methane;2-pyrimidin-4-ylpyridine-3-carboxylic acid;hydrochloride
PubChem CID167537246
Molecular FormulaC93H111BrClF16N13O7
Molecular Weight1942.32 g/mol
Exact Mass1939.73
IUPAC Name2-(bromomethyl)-1-fluoro-4-(trifluoromethyl)benzene;tert-butyl 4-cyanocyclohexane-1-carboxylate;tert-butyl 4-cyano-4-[[2-fluoro-5-(trifluoromethyl)phenyl]methyl]piperidine-1-carboxylate;4-[[2-fluoro-5-(trifluoromethyl)phenyl]methyl]piperidine-4-carbonitrile;4-[[2-fluoro-5-(trifluoromethyl)phenyl]methyl]-1-(2-pyrimidin-4-ylpyridine-3-carbonyl)piperidine-4-carbonitrile;methane;2-pyrimidin-4-ylpyridine-3-carboxylic acid;hydrochloride
SMILESC.C.C.C.C.C.CC(C)(C)OC(=O)C1CCC(C#N)CC1.CC(C)(C)OC(=O)N1CCC(C#N)(Cc2cc(C(F)(F)F)ccc2F)CC1.Cl.Fc1ccc(C(F)(F)F)cc1CBr.N#CC1(Cc2cc(C(F)(F)F)ccc2F)CCN(C(=O)c2cccnc2-c2ccncn2)CC1.N#CC1(Cc2cc(C(F)(F)F)ccc2F)CCNCC1.O=C(O)c1cccnc1-c1ccncn1
InChIInChI=1S/C24H19F4N5O.C19H22F4N2O2.C14H14F4N2.C12H19NO2.C10H7N3O2.C8H5BrF4.6CH4.ClH/c25-19-4-3-17(24(26,27)28)12-16(19)13-23(14-29)6-10-33(11-7-23)22(34)18-2-1-8-31-21(18)20-5-9-30-15-32-20;1-17(2,3)27-16(26)25-8-6-18(12-24,7-9-25)11-13-10-14(19(21,22)23)4-5-15(13)20;15-12-2-1-11(14(16,17)18)7-10(12)8-13(9-19)3-5-20-6-4-13;1-12(2,3)15-11(14)10-6-4-9(8-13)5-7-10;14-10(15)7-2-1-4-12-9(7)8-3-5-11-6-13-8;9-4-5-3-6(8(11,12)13)1-2-7(5)10;;;;;;;/h1-5,8-9,12,15H,6-7,10-11,13H2;4-5,10H,6-9,11H2,1-3H3;1-2,7,20H,3-6,8H2;9-10H,4-7H2,1-3H3;1-6H,(H,14,15);1-3H,4H2;6*1H4;1H
InChIKeyPBXRCOKHYNKJIQ-UHFFFAOYSA-N
XLogP24.77
TPSA297.98 Ų
H-Bond Donors2
H-Bond Acceptors17
Rotatable Bonds12
Heavy Atoms131
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5001942.32
LogP ≤ 524.77
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 1017

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'alkyl_halide', 'substructure': 'N/A'}

Analyze 2-(bromomethyl)-1-fluoro-4-(trifluoromethyl)benzene;tert-butyl 4-cyanocyclohexane-1-carboxylate;tert-butyl 4-cyano-4-[[2-fluoro-5-(trifluoromethyl)phenyl]methyl]piperidine-1-carboxylate;4-[[2-fluoro-5-(trifluoromethyl)phenyl]methyl]piperidine-4-carbonitrile;4-[[2-fluoro-5-(trifluoromethyl)phenyl]methyl]-1-(2-pyrimidin-4-ylpyridine-3-carbonyl)piperidine-4-carbonitrile;methane;2-pyrimidin-4-ylpyridine-3-carboxylic acid;hydrochloride 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

4-(Bromomethyl)-1-fluoro-2-(trifluoromethyl)benzene;tert-butyl 4-cyano-4-[[4-fluoro-3-(trifluoromethyl)phenyl]methyl]piperidine-1-carboxylate;tert-butyl 4-cyanopiperidine-1-carboxylate;4-[[4-fluoro-3-(trifluoromethyl)phenyl]methyl]piperidine-4-carbonitrile;4-[[4-fluoro-3-(trifluoromethyl)phenyl]methyl]-1-(2-pyrimidin-4-ylpyridine-3-carbonyl)piperidine-4-carbonitrile;methane;2-pyrimidin-4-ylpyridine-3-carboxylic acid;hydrochloride
CID 167532651
4-[(4-Fluorophenyl)methyl]-1-(2-pyridin-4-ylbenzoyl)piperidine-4-carbonitrile;4-[(4-fluorophenyl)methyl]-1-[2-pyridin-4-yl-5-(trifluoromethyl)benzoyl]piperidine-4-carbonitrile;4-[[4-(2-hydroxypropan-2-yl)phenyl]methyl]-1-(2-pyrimidin-4-ylbenzoyl)piperidine-4-carbonitrile;4-(naphthalen-2-ylmethyl)-1-(2-pyrimidin-4-ylbenzoyl)piperidine-4-carbonitrile;1-(2-pyrimidin-4-ylbenzoyl)-4-[[5-(trifluoromethyl)-2-pyridinyl]methyl]piperidine-4-carbonitrile
CID 167573198
1-(Bromomethyl)-2-fluoro-3-methylbenzene;tert-butyl 4-cyano-4-[[2-fluoro-3-(trifluoromethyl)phenyl]methyl]piperidine-1-carboxylate;tert-butyl 4-cyanopiperidine-1-carboxylate;4-[[2-fluoro-3-(trifluoromethyl)phenyl]methyl]piperidine-4-carbonitrile;4-[[2-fluoro-3-(trifluoromethyl)phenyl]methyl]-1-(2-pyrimidin-4-ylpyridine-3-carbonyl)piperidine-4-carbonitrile;methane;2-pyrimidin-4-ylpyridine-3-carboxylic acid;hydrochloride
CID 167576289
1-(Bromomethyl)-4-fluoro-2-(trifluoromethyl)benzene;tert-butyl 4-cyano-4-[(4-fluoro-2-methylphenyl)methyl]piperidine-1-carboxylate;tert-butyl 4-cyanopiperidine-1-carboxylate;4-[(4-fluoro-2-methylphenyl)methyl]piperidine-4-carbonitrile;4-[[4-fluoro-2-(trifluoromethyl)phenyl]methyl]-1-(2-pyrimidin-4-ylpyridine-3-carbonyl)piperidine-4-carbonitrile;methane;2-pyrimidin-4-ylpyridine-3-carboxylic acid;hydrochloride
CID 167589455
2-(Bromomethyl)-1,3-difluoro-5-(trifluoromethyl)benzene;tert-butyl 4-cyano-4-[(2,6-difluoro-4-methylphenyl)methyl]piperidine-1-carboxylate;cyclohexanecarbonitrile;4-[(2,6-difluoro-4-methylphenyl)methyl]piperidine-4-carbonitrile;4-[[2,6-difluoro-4-(trifluoromethyl)phenyl]methyl]-1-(2-pyridin-4-ylpyridine-3-carbonyl)piperidine-4-carbonitrile;methane;2-pyrimidin-4-ylpyridine-3-carboxylic acid;hydrochloride
CID 167600919
3-(Bromomethyl)-1,1-difluorocyclobutane;tert-butyl 4-cyano-4-[(3,3-difluorocyclobutyl)methyl]piperidine-1-carboxylate;tert-butyl 4-cyanopiperidine-1-carboxylate;4-[(3,3-difluorocyclobutyl)methyl]piperidine-4-carbonitrile;4-[(3,3-difluorocyclobutyl)methyl]-1-(2-pyrimidin-4-ylpyridine-3-carbonyl)piperidine-4-carbonitrile;methane;2-pyrimidin-4-ylpyridine-3-carboxylic acid
CID 167602943
Tert-butyl 4-cyanopiperidine-1-carboxylate;tert-butyl 4-cyano-4-[[4-(trifluoromethyl)phenyl]methyl]piperidine-1-carboxylate;1-(chloromethyl)-4-(trifluoromethyl)benzene;methane;1-(2-pyrimidin-4-ylpyridine-3-carbonyl)-4-[[4-(trifluoromethyl)phenyl]methyl]piperidine-4-carbonitrile;2-pyrimidin-4-ylpyridine-3-carboxylic acid;4-[[4-(trifluoromethyl)phenyl]methyl]piperidine-4-carbonitrile
CID 167604582
1-(Bromomethyl)-2-fluoro-4-methylbenzene;tert-butyl 4-cyano-4-[[2-fluoro-4-(trifluoromethyl)phenyl]methyl]piperidine-1-carboxylate;cyclohexanecarbonitrile;4-[[2-fluoro-4-(trifluoromethyl)phenyl]methyl]piperidine-4-carbonitrile;4-[[2-fluoro-4-(trifluoromethyl)phenyl]methyl]-1-(2-pyrimidin-4-ylpyridine-3-carbonyl)piperidine-4-carbonitrile;methane;2-pyrimidin-4-ylpyridine-3-carboxylic acid;hydrochloride
CID 167611011
CID 167628890
CID 167628890
1-(Bromomethyl)-2-fluoro-4-methylbenzene;tert-butyl 4-cyano-4-[[2-fluoro-4-(trifluoromethyl)phenyl]methyl]piperidine-1-carboxylate;cyclohexanecarbonitrile;4-[[2-fluoro-4-(trifluoromethyl)phenyl]methyl]piperidine-4-carbonitrile;4-[[2-fluoro-4-(trifluoromethyl)phenyl]methyl]-1-(2-pyridin-4-ylpyridine-3-carbonyl)piperidine-4-carbonitrile;methane;2-pyridin-4-ylpyridine-3-carboxylic acid;hydrochloride
CID 167636784
1-(Bromomethyl)-4-(trifluoromethoxy)benzene;tert-butyl 4-cyanopiperidine-1-carboxylate;tert-butyl 4-cyano-4-[[4-(trifluoromethoxy)phenyl]methyl]piperidine-1-carboxylate;methane;1-(2-pyrimidin-4-ylpyridine-3-carbonyl)-4-[[4-(trifluoromethoxy)phenyl]methyl]piperidine-4-carbonitrile;2-pyrimidin-4-ylpyridine-3-carboxylic acid;4-[[4-(trifluoromethoxy)phenyl]methyl]piperidine-4-carbonitrile;hydrochloride
CID 167640451
2-(Bromomethyl)-5-(trifluoromethyl)pyridine;tert-butyl 4-cyanopiperidine-1-carboxylate;tert-butyl 4-cyano-4-[[5-(trifluoromethyl)-2-pyridinyl]methyl]piperidine-1-carboxylate;chloroform;methane;1-(2-pyrimidin-4-ylpyridine-3-carbonyl)-4-[[5-(trifluoromethyl)-2-pyridinyl]methyl]piperidine-4-carbonitrile;2-pyrimidin-4-ylpyridine-3-carboxylic acid;tribromophosphane;[5-(trifluoromethyl)-2-pyridinyl]methanol;4-[[5-(trifluoromethyl)-2-pyridinyl]methyl]piperidine-4-carbonitrile;hydrochloride
CID 167658761

Frequently Asked Questions

What is the IUPAC name of 2-(bromomethyl)-1-fluoro-4-(trifluoromethyl)benzene;tert-butyl 4-cyanocyclohexane-1-carboxylate;tert-butyl 4-cyano-4-[[2-fluoro-5-(trifluoromethyl)phenyl]methyl]piperidine-1-carboxylate;4-[[2-fluoro-5-(trifluoromethyl)phenyl]methyl]piperidine-4-carbonitrile;4-[[2-fluoro-5-(trifluoromethyl)phenyl]methyl]-1-(2-pyrimidin-4-ylpyridine-3-carbonyl)piperidine-4-carbonitrile;methane;2-pyrimidin-4-ylpyridine-3-carboxylic acid;hydrochloride?
The IUPAC name of 2-(bromomethyl)-1-fluoro-4-(trifluoromethyl)benzene;tert-butyl 4-cyanocyclohexane-1-carboxylate;tert-butyl 4-cyano-4-[[2-fluoro-5-(trifluoromethyl)phenyl]methyl]piperidine-1-carboxylate;4-[[2-fluoro-5-(trifluoromethyl)phenyl]methyl]piperidine-4-carbonitrile;4-[[2-fluoro-5-(trifluoromethyl)phenyl]methyl]-1-(2-pyrimidin-4-ylpyridine-3-carbonyl)piperidine-4-carbonitrile;methane;2-pyrimidin-4-ylpyridine-3-carboxylic acid;hydrochloride (CID 167537246) is 2-(bromomethyl)-1-fluoro-4-(trifluoromethyl)benzene;tert-butyl 4-cyanocyclohexane-1-carboxylate;tert-butyl 4-cyano-4-[[2-fluoro-5-(trifluoromethyl)phenyl]methyl]piperidine-1-carboxylate;4-[[2-fluoro-5-(trifluoromethyl)phenyl]methyl]piperidine-4-carbonitrile;4-[[2-fluoro-5-(trifluoromethyl)phenyl]methyl]-1-(2-pyrimidin-4-ylpyridine-3-carbonyl)piperidine-4-carbonitrile;methane;2-pyrimidin-4-ylpyridine-3-carboxylic acid;hydrochloride.
What is the SMILES notation for 2-(bromomethyl)-1-fluoro-4-(trifluoromethyl)benzene;tert-butyl 4-cyanocyclohexane-1-carboxylate;tert-butyl 4-cyano-4-[[2-fluoro-5-(trifluoromethyl)phenyl]methyl]piperidine-1-carboxylate;4-[[2-fluoro-5-(trifluoromethyl)phenyl]methyl]piperidine-4-carbonitrile;4-[[2-fluoro-5-(trifluoromethyl)phenyl]methyl]-1-(2-pyrimidin-4-ylpyridine-3-carbonyl)piperidine-4-carbonitrile;methane;2-pyrimidin-4-ylpyridine-3-carboxylic acid;hydrochloride?
The canonical SMILES for 2-(bromomethyl)-1-fluoro-4-(trifluoromethyl)benzene;tert-butyl 4-cyanocyclohexane-1-carboxylate;tert-butyl 4-cyano-4-[[2-fluoro-5-(trifluoromethyl)phenyl]methyl]piperidine-1-carboxylate;4-[[2-fluoro-5-(trifluoromethyl)phenyl]methyl]piperidine-4-carbonitrile;4-[[2-fluoro-5-(trifluoromethyl)phenyl]methyl]-1-(2-pyrimidin-4-ylpyridine-3-carbonyl)piperidine-4-carbonitrile;methane;2-pyrimidin-4-ylpyridine-3-carboxylic acid;hydrochloride is C.C.C.C.C.C.CC(C)(C)OC(=O)C1CCC(C#N)CC1.CC(C)(C)OC(=O)N1CCC(C#N)(Cc2cc(C(F)(F)F)ccc2F)CC1.Cl.Fc1ccc(C(F)(F)F)cc1CBr.N#CC1(Cc2cc(C(F)(F)F)ccc2F)CCN(C(=O)c2cccnc2-c2ccncn2)CC1.N#CC1(Cc2cc(C(F)(F)F)ccc2F)CCNCC1.O=C(O)c1cccnc1-c1ccncn1.
What is the InChIKey of 2-(bromomethyl)-1-fluoro-4-(trifluoromethyl)benzene;tert-butyl 4-cyanocyclohexane-1-carboxylate;tert-butyl 4-cyano-4-[[2-fluoro-5-(trifluoromethyl)phenyl]methyl]piperidine-1-carboxylate;4-[[2-fluoro-5-(trifluoromethyl)phenyl]methyl]piperidine-4-carbonitrile;4-[[2-fluoro-5-(trifluoromethyl)phenyl]methyl]-1-(2-pyrimidin-4-ylpyridine-3-carbonyl)piperidine-4-carbonitrile;methane;2-pyrimidin-4-ylpyridine-3-carboxylic acid;hydrochloride?
The InChIKey is PBXRCOKHYNKJIQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H19F4N5O.C19H22F4N2O2.C14H14F4N2.C12H19NO2.C10H7N3O2.C8H5BrF4.6CH4.ClH/c25-19-4-3-17(24(26,27)28)12-16(19)13-23(14-29)6-10-33(11-7-23)22(34)18-2-1-8-31-21(18)20-5-9-30-15-32-20;1-17(2,3)27-16(26)25-8-6-18(12-24,7-9-25)11-13-10-14(19(21,22)23)4-5-15(13)20;15-12-2-1-11(14(16,17)18)7-10(12)8-13(9-19)3-5-20-6-4-13;1-12(2,3)15-11(14)10-6-4-9(8-13)5-7-10;14-10(15)7-2-1-4-12-9(7)8-3-5-11-6-13-8;9-4-5-3-6(8(11,12)13)1-2-7(5)10;;;;;;;/h1-5,8-9,12,15H,6-7,10-11,13H2;4-5,10H,6-9,11H2,1-3H3;1-2,7,20H,3-6,8H2;9-10H,4-7H2,1-3H3;1-6H,(H,14,15);1-3H,4H2;6*1H4;1H.
What are the key properties of 2-(bromomethyl)-1-fluoro-4-(trifluoromethyl)benzene;tert-butyl 4-cyanocyclohexane-1-carboxylate;tert-butyl 4-cyano-4-[[2-fluoro-5-(trifluoromethyl)phenyl]methyl]piperidine-1-carboxylate;4-[[2-fluoro-5-(trifluoromethyl)phenyl]methyl]piperidine-4-carbonitrile;4-[[2-fluoro-5-(trifluoromethyl)phenyl]methyl]-1-(2-pyrimidin-4-ylpyridine-3-carbonyl)piperidine-4-carbonitrile;methane;2-pyrimidin-4-ylpyridine-3-carboxylic acid;hydrochloride?
2-(bromomethyl)-1-fluoro-4-(trifluoromethyl)benzene;tert-butyl 4-cyanocyclohexane-1-carboxylate;tert-butyl 4-cyano-4-[[2-fluoro-5-(trifluoromethyl)phenyl]methyl]piperidine-1-carboxylate;4-[[2-fluoro-5-(trifluoromethyl)phenyl]methyl]piperidine-4-carbonitrile;4-[[2-fluoro-5-(trifluoromethyl)phenyl]methyl]-1-(2-pyrimidin-4-ylpyridine-3-carbonyl)piperidine-4-carbonitrile;methane;2-pyrimidin-4-ylpyridine-3-carboxylic acid;hydrochloride has a molecular weight of 1942.32 g/mol, XLogP of 24.77, 12 rotatable bonds, 2 hydrogen bond donors, and 17 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(bromomethyl)-1-fluoro-4-(trifluoromethyl)benzene;tert-butyl 4-cyanocyclohexane-1-carboxylate;tert-butyl 4-cyano-4-[[2-fluoro-5-(trifluoromethyl)phenyl]methyl]piperidine-1-carboxylate;4-[[2-fluoro-5-(trifluoromethyl)phenyl]methyl]piperidine-4-carbonitrile;4-[[2-fluoro-5-(trifluoromethyl)phenyl]methyl]-1-(2-pyrimidin-4-ylpyridine-3-carbonyl)piperidine-4-carbonitrile;methane;2-pyrimidin-4-ylpyridine-3-carboxylic acid;hydrochloride is sourced from PubChem (CID 167537246), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).