benzoyl chloride;tert-butyl 2-[[6-(4-ethylpiperazin-1-yl)-9-[3-(4-ethylpiperazin-1-yl)propyl]purin-2-yl]carbamoyl]pyrrolidine-1-carboxylate;dichloromethane;N-[6-(4-ethylpiperazin-1-yl)-9-[3-(4-ethylpiperazin-1-yl)propyl]purin-2-yl]benzamide;N-[6-(4-ethylpiperazin-1-yl)-9-[3-(4-ethylpiperazin-1-yl)propyl]purin-2-yl]pyrrolidine-2-carboxamide;1-[(2-methylpropan-2-yl)oxycarbonyl]pyrrolidine-2-carboxylic acid

C100H155Cl3N30O10 — CID 158254750

IUPACbenzoyl chloride;tert-butyl 2-[[6-(4-ethylpiperazin-1-yl)-9-[3-(4-ethylpiperazin-1-yl)propyl]purin-2-yl]carbamoyl]pyrrolidine-1-carboxylate;dichloromethane;N-[6-(4-ethylpiperazin-1-yl)-9-[3-(4-ethylpiperazin-1-yl)propyl]purin-2-yl]benzamide;N-[6-(4-ethylpiperazin-1-yl)-9-[3-(4-ethylpiperazin-1-yl)propyl]purin-2-yl]pyrrolidine-2-carboxamide;1-[(2-methylpropan-2-yl)oxycarbonyl]pyrrolidine-2-carboxylic acid
SMILESCC(C)(C)OC(=O)N1CCCC1C(=O)O.CCN1CCN(CCCn2cnc3c(N4CCN(CC)CC4)nc(NC(=O)C4CCCN4)nc32)CC1.CCN1CCN(CCCn2cnc3c(N4CCN(CC)CC4)nc(NC(=O)C4CCCN4C(=O)OC(C)(C)C)nc32)CC1.CCN1CCN(CCCn2cnc3c(N4CCN(CC)CC4)nc(NC(=O)c4ccccc4)nc32)CC1.ClCCl.O=C(Cl)c1ccccc1
InChIInChI=1S/C30H50N10O3.C27H39N9O.C25H42N10O.C10H17NO4.C7H5ClO.CH2Cl2/c1-6-35-14-16-37(17-15-35)11-9-12-39-22-31-24-25(38-20-18-36(7-2)19-21-38)32-28(33-26(24)39)34-27(41)23-10-8-13-40(23)29(42)43-30(3,4)5;1-3-32-13-15-34(16-14-32)11-8-12-36-21-28-23-24(35-19-17-33(4-2)18-20-35)29-27(30-25(23)36)31-26(37)22-9-6-5-7-10-22;1-3-31-11-13-33(14-12-31)9-6-10-35-19-27-21-22(34-17-15-32(4-2)16-18-34)28-25(29-23(21)35)30-24(36)20-7-5-8-26-20;1-10(2,3)15-9(14)11-6-4-5-7(11)8(12)13;8-7(9)6-4-2-1-3-5-6;2-1-3/h22-23H,6-21H2,1-5H3,(H,32,33,34,41);5-7,9-10,21H,3-4,8,11-20H2,1-2H3,(H,29,30,31,37);19-20,26H,3-18H2,1-2H3,(H,28,29,30,36);7H,4-6H2,1-3H3,(H,12,13);1-5H;1H2
InChIKeyGHDKMKCURZMUBW-UHFFFAOYSA-N
MW2043.90 g/mol
LogP10.23
Rot. Bonds29

About benzoyl chloride;tert-butyl 2-[[6-(4-ethylpiperazin-1-yl)-9-[3-(4-ethylpiperazin-1-yl)propyl]purin-2-yl]carbamoyl]pyrrolidine-1-carboxylate;dichloromethane;N-[6-(4-ethylpiperazin-1-yl)-9-[3-(4-ethylpiperazin-1-yl)propyl]purin-2-yl]benzamide;N-[6-(4-ethylpiperazin-1-yl)-9-[3-(4-ethylpiperazin-1-yl)propyl]purin-2-yl]pyrrolidine-2-carboxamide;1-[(2-methylpropan-2-yl)oxycarbonyl]pyrrolidine-2-carboxylic acid

benzoyl chloride;tert-butyl 2-[[6-(4-ethylpiperazin-1-yl)-9-[3-(4-ethylpiperazin-1-yl)propyl]purin-2-yl]carbamoyl]pyrrolidine-1-carboxylate;dichloromethane;N-[6-(4-ethylpiperazin-1-yl)-9-[3-(4-ethylpiperazin-1-yl)propyl]purin-2-yl]benzamide;N-[6-(4-ethylpiperazin-1-yl)-9-[3-(4-ethylpiperazin-1-yl)propyl]purin-2-yl]pyrrolidine-2-carboxamide;1-[(2-methylpropan-2-yl)oxycarbonyl]pyrrolidine-2-carboxylic acid (PubChem CID 158254750) has the molecular formula C100H155Cl3N30O10 and a molecular weight of 2043.90 g/mol. Its IUPAC name is benzoyl chloride;tert-butyl 2-[[6-(4-ethylpiperazin-1-yl)-9-[3-(4-ethylpiperazin-1-yl)propyl]purin-2-yl]carbamoyl]pyrrolidine-1-carboxylate;dichloromethane;N-[6-(4-ethylpiperazin-1-yl)-9-[3-(4-ethylpiperazin-1-yl)propyl]purin-2-yl]benzamide;N-[6-(4-ethylpiperazin-1-yl)-9-[3-(4-ethylpiperazin-1-yl)propyl]purin-2-yl]pyrrolidine-2-carboxamide;1-[(2-methylpropan-2-yl)oxycarbonyl]pyrrolidine-2-carboxylic acid.

Molecular Properties

Compound Namebenzoyl chloride;tert-butyl 2-[[6-(4-ethylpiperazin-1-yl)-9-[3-(4-ethylpiperazin-1-yl)propyl]purin-2-yl]carbamoyl]pyrrolidine-1-carboxylate;dichloromethane;N-[6-(4-ethylpiperazin-1-yl)-9-[3-(4-ethylpiperazin-1-yl)propyl]purin-2-yl]benzamide;N-[6-(4-ethylpiperazin-1-yl)-9-[3-(4-ethylpiperazin-1-yl)propyl]purin-2-yl]pyrrolidine-2-carboxamide;1-[(2-methylpropan-2-yl)oxycarbonyl]pyrrolidine-2-carboxylic acid
PubChem CID158254750
Molecular FormulaC100H155Cl3N30O10
Molecular Weight2043.90 g/mol
Exact Mass2041.16
IUPAC Namebenzoyl chloride;tert-butyl 2-[[6-(4-ethylpiperazin-1-yl)-9-[3-(4-ethylpiperazin-1-yl)propyl]purin-2-yl]carbamoyl]pyrrolidine-1-carboxylate;dichloromethane;N-[6-(4-ethylpiperazin-1-yl)-9-[3-(4-ethylpiperazin-1-yl)propyl]purin-2-yl]benzamide;N-[6-(4-ethylpiperazin-1-yl)-9-[3-(4-ethylpiperazin-1-yl)propyl]purin-2-yl]pyrrolidine-2-carboxamide;1-[(2-methylpropan-2-yl)oxycarbonyl]pyrrolidine-2-carboxylic acid
SMILESCC(C)(C)OC(=O)N1CCCC1C(=O)O.CCN1CCN(CCCn2cnc3c(N4CCN(CC)CC4)nc(NC(=O)C4CCCN4)nc32)CC1.CCN1CCN(CCCn2cnc3c(N4CCN(CC)CC4)nc(NC(=O)C4CCCN4C(=O)OC(C)(C)C)nc32)CC1.CCN1CCN(CCCn2cnc3c(N4CCN(CC)CC4)nc(NC(=O)c4ccccc4)nc32)CC1.ClCCl.O=C(Cl)c1ccccc1
InChIInChI=1S/C30H50N10O3.C27H39N9O.C25H42N10O.C10H17NO4.C7H5ClO.CH2Cl2/c1-6-35-14-16-37(17-15-35)11-9-12-39-22-31-24-25(38-20-18-36(7-2)19-21-38)32-28(33-26(24)39)34-27(41)23-10-8-13-40(23)29(42)43-30(3,4)5;1-3-32-13-15-34(16-14-32)11-8-12-36-21-28-23-24(35-19-17-33(4-2)18-20-35)29-27(30-25(23)36)31-26(37)22-9-6-5-7-10-22;1-3-31-11-13-33(14-12-31)9-6-10-35-19-27-21-22(34-17-15-32(4-2)16-18-34)28-25(29-23(21)35)30-24(36)20-7-5-8-26-20;1-10(2,3)15-9(14)11-6-4-5-7(11)8(12)13;8-7(9)6-4-2-1-3-5-6;2-1-3/h22-23H,6-21H2,1-5H3,(H,32,33,34,41);5-7,9-10,21H,3-4,8,11-20H2,1-2H3,(H,29,30,31,37);19-20,26H,3-18H2,1-2H3,(H,28,29,30,36);7H,4-6H2,1-3H3,(H,12,13);1-5H;1H2
InChIKeyGHDKMKCURZMUBW-UHFFFAOYSA-N
XLogP10.23
TPSA382.46 Ų
H-Bond Donors5
H-Bond Acceptors34
Rotatable Bonds29
Heavy Atoms143
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002043.90
LogP ≤ 510.23
H-Bond Donors ≤ 55
H-Bond Acceptors ≤ 1034

Computed Properties (RDKit)

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

Analyze benzoyl chloride;tert-butyl 2-[[6-(4-ethylpiperazin-1-yl)-9-[3-(4-ethylpiperazin-1-yl)propyl]purin-2-yl]carbamoyl]pyrrolidine-1-carboxylate;dichloromethane;N-[6-(4-ethylpiperazin-1-yl)-9-[3-(4-ethylpiperazin-1-yl)propyl]purin-2-yl]benzamide;N-[6-(4-ethylpiperazin-1-yl)-9-[3-(4-ethylpiperazin-1-yl)propyl]purin-2-yl]pyrrolidine-2-carboxamide;1-[(2-methylpropan-2-yl)oxycarbonyl]pyrrolidine-2-carboxylic acid 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

2-[2-[(4-Cyclohexylphenyl)methyl-[(2-methylpropan-2-yl)oxycarbonyl]amino]-6-(propylamino)purin-9-yl]acetic acid;ethyl 2-(2-amino-6-chloropurin-9-yl)acetate;ethyl 2-[6-chloro-2-[(4-hexan-3-ylbenzoyl)amino]purin-9-yl]acetate;ethyl 2-[2-[(4-cyclohexylphenyl)methyl-[(2-methylpropan-2-yl)oxycarbonyl]amino]-6-(3-methylbutylamino)purin-9-yl]acetate
CID 157232836
tert-butyl N-(6-chloro-7H-purin-2-yl)carbamate;ethyl 2-[6-chloro-2-[(4-cyclohexylbenzoyl)amino]purin-9-yl]acetate;ethyl 2-[6-chloro-2-[(4-cyclohexylphenyl)methyl-[(2-methylpropan-2-yl)oxycarbonyl]amino]purin-9-yl]acetate;ethyl 2-[6-chloro-2-[(2-methylpropan-2-yl)oxycarbonylamino]purin-9-yl]acetate;ethyl 2-[6-chloro-2-[(2-methylpropan-2-yl)oxycarbonyl-pentylamino]purin-9-yl]acetate
CID 157293616
Ethyl 2-[6-(butylamino)-2-[(4-cyclohexylbenzoyl)amino]purin-9-yl]acetate;ethyl 2-[2-(cyclohexanecarbonylamino)-6-morpholin-4-ylpurin-9-yl]acetate;ethyl 2-[2-[(4-cyclohexylbenzoyl)amino]-6-morpholin-4-ylpurin-9-yl]acetate;ethyl 2-(2-methyl-6-morpholin-4-ylpurin-9-yl)acetate;ethyl 2-[2-[(2-methylpropan-2-yl)oxycarbonylamino]-6-morpholin-4-ylpurin-9-yl]acetate
CID 157466802
2-[6-anilino-2-[(2-methylpropan-2-yl)oxycarbonyl-pentylamino]purin-9-yl]acetic acid;2-[6-[benzyl(methyl)amino]-2-[(2-methylpropan-2-yl)oxycarbonyl-pentylamino]purin-9-yl]acetic acid;tert-butyl 2-amino-6-chloropurine-9-carboxylate;tert-butyl N-(6-chloro-7H-purin-2-yl)carbamate;2-[2-(pentylamino)-6-(propan-2-ylamino)purin-9-yl]acetic acid
CID 157468140
N-[9-[(2R,4S,5S)-4-amino-5-[1-[di(propan-2-yl)amino]ethoxymethyl]-3-methoxyoxolan-2-yl]purin-6-yl]benzamide;N-[9-[(2R,4S,5R)-4-amino-5-ethyl-3-methoxyoxolan-2-yl]purin-6-yl]benzamide;[(2R,4S,5R)-4-azido-2-(6-benzamidopurin-9-yl)-5-ethyloxolan-3-yl] acetate;N-[9-[(2R,4S,5R)-4-azido-5-ethyl-3-methoxyoxolan-2-yl]purin-6-yl]benzamide;9-[(2R,4S,5R)-4-azido-5-ethyl-3-methoxyoxolan-2-yl]-N-(2-tritioethyl)purin-6-amine;bis(tritioethane)
CID 158221094
tert-butyl 3-[[9-ethyl-8-(2-methylpyrimidin-5-yl)purin-6-yl]amino]pyrrolidine-1-carboxylate;1-[3-[[9-ethyl-8-(2-methylpyrimidin-5-yl)purin-6-yl]amino]pyrrolidin-1-yl]-2-phenylethanone;9-ethyl-8-(2-methylpyrimidin-5-yl)-N-pyrrolidin-3-ylpurin-6-amine;2-phenylacetic acid
CID 158403926
acetic acid;4-[[6-amino-8-bromo-2-[2-(dimethylamino)ethoxy]purin-9-yl]methyl]benzonitrile;4-[(6-amino-2-chloropurin-9-yl)methyl]benzonitrile;4-[[6-amino-2-[2-(dimethylamino)ethoxy]-8-methoxypurin-9-yl]methyl]benzonitrile;4-[[6-amino-2-[2-(dimethylamino)ethoxy]-8-oxo-7H-purin-9-yl]methyl]benzamide;4-[[6-amino-2-[2-(dimethylamino)ethoxy]-8-oxo-7H-purin-9-yl]methyl]benzonitrile;4-[[6-amino-2-[2-(dimethylamino)ethoxy]purin-9-yl]methyl]benzonitrile;molecular bromine;hydrochloride
CID 159227063
Ethyl 2-[6-(benzylamino)-2-[(4-cyclohexylbenzoyl)amino]purin-9-yl]acetate;ethyl 2-[6-(benzylamino)-2-[(4-cyclohexylphenyl)methyl-[(2-methylpropan-2-yl)oxycarbonyl]amino]purin-9-yl]acetate;ethyl 2-[6-(3-methylbutylamino)-2-[(2-methylpropan-2-yl)oxycarbonyl-pentylamino]purin-9-yl]acetate;ethyl 2-[2-[(2-methylpropan-2-yl)oxycarbonyl-pentylamino]-6-(oxan-4-ylamino)purin-9-yl]acetate
CID 159780107
2-[6-(Butylamino)-2-[(4-cyclohexylbenzoyl)amino]purin-9-yl]acetic acid;ethyl 2-[6-chloro-2-[(4-cyclohexylbenzoyl)amino]purin-9-yl]acetate;ethyl 2-(6-chloro-2-methylpurin-9-yl)acetate;ethyl 2-(2-methyl-6-morpholin-4-ylpurin-9-yl)acetate
CID 159996886
Ethyl 2-[6-chloro-2-[(4-cyclohexylbenzoyl)-[(2-methylpropan-2-yl)oxycarbonyl]amino]purin-9-yl]acetate;ethyl 2-[6-chloro-2-[(2-methylpropan-2-yl)oxycarbonylamino]purin-9-yl]acetate;ethyl 2-[6-chloro-2-[(2-methylpropan-2-yl)oxycarbonyl-pentylamino]purin-9-yl]acetate;ethyl 2-(6-chloro-2-methylpurin-9-yl)acetate;ethyl 2-(2-methyl-6-morpholin-4-ylpurin-9-yl)acetate;methane
CID 160759633
(2S,5S)-2-amino-6-[(2R,3R,5R)-5-(6-aminopurin-9-yl)-3,4-dihydroxyoxolan-2-yl]-5-(benzylamino)hexanamide;(2S,5S)-2-amino-5-[[(2R,3R,5R)-5-(6-aminopurin-9-yl)-3,4-dihydroxyoxolan-2-yl]methyl]-7-phenylheptanamide;(2S,5S)-2,5-diamino-6-[(2R,3R,5R)-5-(6-aminopurin-9-yl)-3,4-dihydroxyoxolan-2-yl]hexanamide;methyl (2S,5S)-2-acetamido-5-[[(2R,3S,5R)-3,4-diacetyloxy-5-(6-benzamidopurin-9-yl)oxolan-2-yl]methyl]-7-phenylheptanoate
CID 160922349
Ethyl 2-(2-amino-6-chloropurin-9-yl)acetate;ethyl 2-(2-amino-6-morpholin-4-ylpurin-9-yl)acetate;ethyl 2-[6-(butylamino)-2-[(4-cyclohexylbenzoyl)amino]purin-9-yl]acetate;ethyl 2-[2-(cyclohexanecarbonylamino)-6-morpholin-4-ylpurin-9-yl]acetate;ethyl 2-[2-[(4-cyclohexylbenzoyl)amino]-6-morpholin-4-ylpurin-9-yl]acetate
CID 161195178

Frequently Asked Questions

What is the IUPAC name of benzoyl chloride;tert-butyl 2-[[6-(4-ethylpiperazin-1-yl)-9-[3-(4-ethylpiperazin-1-yl)propyl]purin-2-yl]carbamoyl]pyrrolidine-1-carboxylate;dichloromethane;N-[6-(4-ethylpiperazin-1-yl)-9-[3-(4-ethylpiperazin-1-yl)propyl]purin-2-yl]benzamide;N-[6-(4-ethylpiperazin-1-yl)-9-[3-(4-ethylpiperazin-1-yl)propyl]purin-2-yl]pyrrolidine-2-carboxamide;1-[(2-methylpropan-2-yl)oxycarbonyl]pyrrolidine-2-carboxylic acid?
The IUPAC name of benzoyl chloride;tert-butyl 2-[[6-(4-ethylpiperazin-1-yl)-9-[3-(4-ethylpiperazin-1-yl)propyl]purin-2-yl]carbamoyl]pyrrolidine-1-carboxylate;dichloromethane;N-[6-(4-ethylpiperazin-1-yl)-9-[3-(4-ethylpiperazin-1-yl)propyl]purin-2-yl]benzamide;N-[6-(4-ethylpiperazin-1-yl)-9-[3-(4-ethylpiperazin-1-yl)propyl]purin-2-yl]pyrrolidine-2-carboxamide;1-[(2-methylpropan-2-yl)oxycarbonyl]pyrrolidine-2-carboxylic acid (CID 158254750) is benzoyl chloride;tert-butyl 2-[[6-(4-ethylpiperazin-1-yl)-9-[3-(4-ethylpiperazin-1-yl)propyl]purin-2-yl]carbamoyl]pyrrolidine-1-carboxylate;dichloromethane;N-[6-(4-ethylpiperazin-1-yl)-9-[3-(4-ethylpiperazin-1-yl)propyl]purin-2-yl]benzamide;N-[6-(4-ethylpiperazin-1-yl)-9-[3-(4-ethylpiperazin-1-yl)propyl]purin-2-yl]pyrrolidine-2-carboxamide;1-[(2-methylpropan-2-yl)oxycarbonyl]pyrrolidine-2-carboxylic acid.
What is the SMILES notation for benzoyl chloride;tert-butyl 2-[[6-(4-ethylpiperazin-1-yl)-9-[3-(4-ethylpiperazin-1-yl)propyl]purin-2-yl]carbamoyl]pyrrolidine-1-carboxylate;dichloromethane;N-[6-(4-ethylpiperazin-1-yl)-9-[3-(4-ethylpiperazin-1-yl)propyl]purin-2-yl]benzamide;N-[6-(4-ethylpiperazin-1-yl)-9-[3-(4-ethylpiperazin-1-yl)propyl]purin-2-yl]pyrrolidine-2-carboxamide;1-[(2-methylpropan-2-yl)oxycarbonyl]pyrrolidine-2-carboxylic acid?
The canonical SMILES for benzoyl chloride;tert-butyl 2-[[6-(4-ethylpiperazin-1-yl)-9-[3-(4-ethylpiperazin-1-yl)propyl]purin-2-yl]carbamoyl]pyrrolidine-1-carboxylate;dichloromethane;N-[6-(4-ethylpiperazin-1-yl)-9-[3-(4-ethylpiperazin-1-yl)propyl]purin-2-yl]benzamide;N-[6-(4-ethylpiperazin-1-yl)-9-[3-(4-ethylpiperazin-1-yl)propyl]purin-2-yl]pyrrolidine-2-carboxamide;1-[(2-methylpropan-2-yl)oxycarbonyl]pyrrolidine-2-carboxylic acid is CC(C)(C)OC(=O)N1CCCC1C(=O)O.CCN1CCN(CCCn2cnc3c(N4CCN(CC)CC4)nc(NC(=O)C4CCCN4)nc32)CC1.CCN1CCN(CCCn2cnc3c(N4CCN(CC)CC4)nc(NC(=O)C4CCCN4C(=O)OC(C)(C)C)nc32)CC1.CCN1CCN(CCCn2cnc3c(N4CCN(CC)CC4)nc(NC(=O)c4ccccc4)nc32)CC1.ClCCl.O=C(Cl)c1ccccc1.
What is the InChIKey of benzoyl chloride;tert-butyl 2-[[6-(4-ethylpiperazin-1-yl)-9-[3-(4-ethylpiperazin-1-yl)propyl]purin-2-yl]carbamoyl]pyrrolidine-1-carboxylate;dichloromethane;N-[6-(4-ethylpiperazin-1-yl)-9-[3-(4-ethylpiperazin-1-yl)propyl]purin-2-yl]benzamide;N-[6-(4-ethylpiperazin-1-yl)-9-[3-(4-ethylpiperazin-1-yl)propyl]purin-2-yl]pyrrolidine-2-carboxamide;1-[(2-methylpropan-2-yl)oxycarbonyl]pyrrolidine-2-carboxylic acid?
The InChIKey is GHDKMKCURZMUBW-UHFFFAOYSA-N. The full InChI is InChI=1S/C30H50N10O3.C27H39N9O.C25H42N10O.C10H17NO4.C7H5ClO.CH2Cl2/c1-6-35-14-16-37(17-15-35)11-9-12-39-22-31-24-25(38-20-18-36(7-2)19-21-38)32-28(33-26(24)39)34-27(41)23-10-8-13-40(23)29(42)43-30(3,4)5;1-3-32-13-15-34(16-14-32)11-8-12-36-21-28-23-24(35-19-17-33(4-2)18-20-35)29-27(30-25(23)36)31-26(37)22-9-6-5-7-10-22;1-3-31-11-13-33(14-12-31)9-6-10-35-19-27-21-22(34-17-15-32(4-2)16-18-34)28-25(29-23(21)35)30-24(36)20-7-5-8-26-20;1-10(2,3)15-9(14)11-6-4-5-7(11)8(12)13;8-7(9)6-4-2-1-3-5-6;2-1-3/h22-23H,6-21H2,1-5H3,(H,32,33,34,41);5-7,9-10,21H,3-4,8,11-20H2,1-2H3,(H,29,30,31,37);19-20,26H,3-18H2,1-2H3,(H,28,29,30,36);7H,4-6H2,1-3H3,(H,12,13);1-5H;1H2.
What are the key properties of benzoyl chloride;tert-butyl 2-[[6-(4-ethylpiperazin-1-yl)-9-[3-(4-ethylpiperazin-1-yl)propyl]purin-2-yl]carbamoyl]pyrrolidine-1-carboxylate;dichloromethane;N-[6-(4-ethylpiperazin-1-yl)-9-[3-(4-ethylpiperazin-1-yl)propyl]purin-2-yl]benzamide;N-[6-(4-ethylpiperazin-1-yl)-9-[3-(4-ethylpiperazin-1-yl)propyl]purin-2-yl]pyrrolidine-2-carboxamide;1-[(2-methylpropan-2-yl)oxycarbonyl]pyrrolidine-2-carboxylic acid?
benzoyl chloride;tert-butyl 2-[[6-(4-ethylpiperazin-1-yl)-9-[3-(4-ethylpiperazin-1-yl)propyl]purin-2-yl]carbamoyl]pyrrolidine-1-carboxylate;dichloromethane;N-[6-(4-ethylpiperazin-1-yl)-9-[3-(4-ethylpiperazin-1-yl)propyl]purin-2-yl]benzamide;N-[6-(4-ethylpiperazin-1-yl)-9-[3-(4-ethylpiperazin-1-yl)propyl]purin-2-yl]pyrrolidine-2-carboxamide;1-[(2-methylpropan-2-yl)oxycarbonyl]pyrrolidine-2-carboxylic acid has a molecular weight of 2043.90 g/mol, XLogP of 10.23, 29 rotatable bonds, 5 hydrogen bond donors, and 34 hydrogen bond acceptors.
Where does this data come from?
All data for benzoyl chloride;tert-butyl 2-[[6-(4-ethylpiperazin-1-yl)-9-[3-(4-ethylpiperazin-1-yl)propyl]purin-2-yl]carbamoyl]pyrrolidine-1-carboxylate;dichloromethane;N-[6-(4-ethylpiperazin-1-yl)-9-[3-(4-ethylpiperazin-1-yl)propyl]purin-2-yl]benzamide;N-[6-(4-ethylpiperazin-1-yl)-9-[3-(4-ethylpiperazin-1-yl)propyl]purin-2-yl]pyrrolidine-2-carboxamide;1-[(2-methylpropan-2-yl)oxycarbonyl]pyrrolidine-2-carboxylic acid is sourced from PubChem (CID 158254750), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).