[6-(2-aminoethyl)naphthalen-2-yl]-(4-methylpiperazin-1-yl)methanone;2-amino-5-iodobenzoic acid;[6-[2-[(2-chloro-6-isocyanoquinazolin-4-yl)amino]ethyl]naphthalen-2-yl]-(4-methylpiperazin-1-yl)methanone;6-(cyanomethyl)naphthalene-2-carboxylic acid;2,4-dichloro-6-isocyanoquinazoline;6-iodo-1H-quinazoline-2,4-dione;[6-[2-[(6-isocyano-2-methoxyquinazolin-4-yl)amino]ethyl]naphthalen-2-yl]-(4-methylpiperazin-1-yl)methanone;6-isocyano-1H-quinazoline-2,4-dione;methyl 6-(cyanomethyl)naphthalene-2-carboxylate;2-[6-(4-methylpiperazine-1-carbonyl)naphthalen-2-yl]acetonitrile

C151H134Cl3I2N29O15 — CID 165106231

IUPAC[6-(2-aminoethyl)naphthalen-2-yl]-(4-methylpiperazin-1-yl)methanone;2-amino-5-iodobenzoic acid;[6-[2-[(2-chloro-6-isocyanoquinazolin-4-yl)amino]ethyl]naphthalen-2-yl]-(4-methylpiperazin-1-yl)methanone;6-(cyanomethyl)naphthalene-2-carboxylic acid;2,4-dichloro-6-isocyanoquinazoline;6-iodo-1H-quinazoline-2,4-dione;[6-[2-[(6-isocyano-2-methoxyquinazolin-4-yl)amino]ethyl]naphthalen-2-yl]-(4-methylpiperazin-1-yl)methanone;6-isocyano-1H-quinazoline-2,4-dione;methyl 6-(cyanomethyl)naphthalene-2-carboxylate;2-[6-(4-methylpiperazine-1-carbonyl)naphthalen-2-yl]acetonitrile
SMILESCN1CCN(C(=O)c2ccc3cc(CC#N)ccc3c2)CC1.CN1CCN(C(=O)c2ccc3cc(CCN)ccc3c2)CC1.COC(=O)c1ccc2cc(CC#N)ccc2c1.N#CCc1ccc2cc(C(=O)O)ccc2c1.Nc1ccc(I)cc1C(=O)O.O=c1[nH]c(=O)c2cc(I)ccc2[nH]1.[C-]#[N+]c1ccc2[nH]c(=O)[nH]c(=O)c2c1.[C-]#[N+]c1ccc2nc(Cl)nc(Cl)c2c1.[C-]#[N+]c1ccc2nc(Cl)nc(NCCc3ccc4cc(C(=O)N5CCN(C)CC5)ccc4c3)c2c1.[C-]#[N+]c1ccc2nc(OC)nc(NCCc3ccc4cc(C(=O)N5CCN(C)CC5)ccc4c3)c2c1
InChIInChI=1S/C28H28N6O2.C27H25ClN6O.C18H23N3O.C18H19N3O.C14H11NO2.C13H9NO2.C9H3Cl2N3.C9H5N3O2.C8H5IN2O2.C7H6INO2/c1-29-23-8-9-25-24(18-23)26(32-28(31-25)36-3)30-11-10-19-4-5-21-17-22(7-6-20(21)16-19)27(35)34-14-12-33(2)13-15-34;1-29-22-7-8-24-23(17-22)25(32-27(28)31-24)30-10-9-18-3-4-20-16-21(6-5-19(20)15-18)26(35)34-13-11-33(2)12-14-34;2*1-20-8-10-21(11-9-20)18(22)17-5-4-15-12-14(6-7-19)2-3-16(15)13-17;1-17-14(16)13-5-4-11-8-10(6-7-15)2-3-12(11)9-13;14-6-5-9-1-2-11-8-12(13(15)16)4-3-10(11)7-9;1-12-5-2-3-7-6(4-5)8(10)14-9(11)13-7;1-10-5-2-3-7-6(4-5)8(13)12-9(14)11-7;9-4-1-2-6-5(3-4)7(12)11-8(13)10-6;8-4-1-2-6(9)5(3-4)7(10)11/h4-9,16-18H,10-15H2,2-3H3,(H,30,31,32);3-8,15-17H,9-14H2,2H3,(H,30,31,32);2-5,12-13H,6-11,19H2,1H3;2-5,12-13H,6,8-11H2,1H3;2-5,8-9H,6H2,1H3;1-4,7-8H,5H2,(H,15,16);2-4H;2-4H,(H2,11,12,13,14);1-3H,(H2,10,11,12,13);1-3H,9H2,(H,10,11)
InChIKeyZECVSRQKPYTDOY-UHFFFAOYSA-N
MW2955.09 g/mol
LogP25.38
Rot. Bonds21

About [6-(2-aminoethyl)naphthalen-2-yl]-(4-methylpiperazin-1-yl)methanone;2-amino-5-iodobenzoic acid;[6-[2-[(2-chloro-6-isocyanoquinazolin-4-yl)amino]ethyl]naphthalen-2-yl]-(4-methylpiperazin-1-yl)methanone;6-(cyanomethyl)naphthalene-2-carboxylic acid;2,4-dichloro-6-isocyanoquinazoline;6-iodo-1H-quinazoline-2,4-dione;[6-[2-[(6-isocyano-2-methoxyquinazolin-4-yl)amino]ethyl]naphthalen-2-yl]-(4-methylpiperazin-1-yl)methanone;6-isocyano-1H-quinazoline-2,4-dione;methyl 6-(cyanomethyl)naphthalene-2-carboxylate;2-[6-(4-methylpiperazine-1-carbonyl)naphthalen-2-yl]acetonitrile

[6-(2-aminoethyl)naphthalen-2-yl]-(4-methylpiperazin-1-yl)methanone;2-amino-5-iodobenzoic acid;[6-[2-[(2-chloro-6-isocyanoquinazolin-4-yl)amino]ethyl]naphthalen-2-yl]-(4-methylpiperazin-1-yl)methanone;6-(cyanomethyl)naphthalene-2-carboxylic acid;2,4-dichloro-6-isocyanoquinazoline;6-iodo-1H-quinazoline-2,4-dione;[6-[2-[(6-isocyano-2-methoxyquinazolin-4-yl)amino]ethyl]naphthalen-2-yl]-(4-methylpiperazin-1-yl)methanone;6-isocyano-1H-quinazoline-2,4-dione;methyl 6-(cyanomethyl)naphthalene-2-carboxylate;2-[6-(4-methylpiperazine-1-carbonyl)naphthalen-2-yl]acetonitrile (PubChem CID 165106231) has the molecular formula C151H134Cl3I2N29O15 and a molecular weight of 2955.09 g/mol. Its IUPAC name is [6-(2-aminoethyl)naphthalen-2-yl]-(4-methylpiperazin-1-yl)methanone;2-amino-5-iodobenzoic acid;[6-[2-[(2-chloro-6-isocyanoquinazolin-4-yl)amino]ethyl]naphthalen-2-yl]-(4-methylpiperazin-1-yl)methanone;6-(cyanomethyl)naphthalene-2-carboxylic acid;2,4-dichloro-6-isocyanoquinazoline;6-iodo-1H-quinazoline-2,4-dione;[6-[2-[(6-isocyano-2-methoxyquinazolin-4-yl)amino]ethyl]naphthalen-2-yl]-(4-methylpiperazin-1-yl)methanone;6-isocyano-1H-quinazoline-2,4-dione;methyl 6-(cyanomethyl)naphthalene-2-carboxylate;2-[6-(4-methylpiperazine-1-carbonyl)naphthalen-2-yl]acetonitrile.

Molecular Properties

Compound Name[6-(2-aminoethyl)naphthalen-2-yl]-(4-methylpiperazin-1-yl)methanone;2-amino-5-iodobenzoic acid;[6-[2-[(2-chloro-6-isocyanoquinazolin-4-yl)amino]ethyl]naphthalen-2-yl]-(4-methylpiperazin-1-yl)methanone;6-(cyanomethyl)naphthalene-2-carboxylic acid;2,4-dichloro-6-isocyanoquinazoline;6-iodo-1H-quinazoline-2,4-dione;[6-[2-[(6-isocyano-2-methoxyquinazolin-4-yl)amino]ethyl]naphthalen-2-yl]-(4-methylpiperazin-1-yl)methanone;6-isocyano-1H-quinazoline-2,4-dione;methyl 6-(cyanomethyl)naphthalene-2-carboxylate;2-[6-(4-methylpiperazine-1-carbonyl)naphthalen-2-yl]acetonitrile
PubChem CID165106231
Molecular FormulaC151H134Cl3I2N29O15
Molecular Weight2955.09 g/mol
Exact Mass2951.78
IUPAC Name[6-(2-aminoethyl)naphthalen-2-yl]-(4-methylpiperazin-1-yl)methanone;2-amino-5-iodobenzoic acid;[6-[2-[(2-chloro-6-isocyanoquinazolin-4-yl)amino]ethyl]naphthalen-2-yl]-(4-methylpiperazin-1-yl)methanone;6-(cyanomethyl)naphthalene-2-carboxylic acid;2,4-dichloro-6-isocyanoquinazoline;6-iodo-1H-quinazoline-2,4-dione;[6-[2-[(6-isocyano-2-methoxyquinazolin-4-yl)amino]ethyl]naphthalen-2-yl]-(4-methylpiperazin-1-yl)methanone;6-isocyano-1H-quinazoline-2,4-dione;methyl 6-(cyanomethyl)naphthalene-2-carboxylate;2-[6-(4-methylpiperazine-1-carbonyl)naphthalen-2-yl]acetonitrile
SMILESCN1CCN(C(=O)c2ccc3cc(CC#N)ccc3c2)CC1.CN1CCN(C(=O)c2ccc3cc(CCN)ccc3c2)CC1.COC(=O)c1ccc2cc(CC#N)ccc2c1.N#CCc1ccc2cc(C(=O)O)ccc2c1.Nc1ccc(I)cc1C(=O)O.O=c1[nH]c(=O)c2cc(I)ccc2[nH]1.[C-]#[N+]c1ccc2[nH]c(=O)[nH]c(=O)c2c1.[C-]#[N+]c1ccc2nc(Cl)nc(Cl)c2c1.[C-]#[N+]c1ccc2nc(Cl)nc(NCCc3ccc4cc(C(=O)N5CCN(C)CC5)ccc4c3)c2c1.[C-]#[N+]c1ccc2nc(OC)nc(NCCc3ccc4cc(C(=O)N5CCN(C)CC5)ccc4c3)c2c1
InChIInChI=1S/C28H28N6O2.C27H25ClN6O.C18H23N3O.C18H19N3O.C14H11NO2.C13H9NO2.C9H3Cl2N3.C9H5N3O2.C8H5IN2O2.C7H6INO2/c1-29-23-8-9-25-24(18-23)26(32-28(31-25)36-3)30-11-10-19-4-5-21-17-22(7-6-20(21)16-19)27(35)34-14-12-33(2)13-15-34;1-29-22-7-8-24-23(17-22)25(32-27(28)31-24)30-10-9-18-3-4-20-16-21(6-5-19(20)15-18)26(35)34-13-11-33(2)12-14-34;2*1-20-8-10-21(11-9-20)18(22)17-5-4-15-12-14(6-7-19)2-3-16(15)13-17;1-17-14(16)13-5-4-11-8-10(6-7-15)2-3-12(11)9-13;14-6-5-9-1-2-11-8-12(13(15)16)4-3-10(11)7-9;1-12-5-2-3-7-6(4-5)8(10)14-9(11)13-7;1-10-5-2-3-7-6(4-5)8(13)12-9(14)11-7;9-4-1-2-6-5(3-4)7(12)11-8(13)10-6;8-4-1-2-6(9)5(3-4)7(10)11/h4-9,16-18H,10-15H2,2-3H3,(H,30,31,32);3-8,15-17H,9-14H2,2H3,(H,30,31,32);2-5,12-13H,6-11,19H2,1H3;2-5,12-13H,6,8-11H2,1H3;2-5,8-9H,6H2,1H3;1-4,7-8H,5H2,(H,15,16);2-4H;2-4H,(H2,11,12,13,14);1-3H,(H2,10,11,12,13);1-3H,9H2,(H,10,11)
InChIKeyZECVSRQKPYTDOY-UHFFFAOYSA-N
XLogP25.38
TPSA578.02 Ų
H-Bond Donors10
H-Bond Acceptors30
Rotatable Bonds21
Heavy Atoms200
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5002955.09
LogP ≤ 525.38
H-Bond Donors ≤ 510
H-Bond Acceptors ≤ 1030

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aniline', 'substructure': 'N/A'}, {'alert_name': 'Carbo_cation/anion', 'substructure': 'N/A'}, {'alert_name': 'iodine', 'substructure': 'N/A'}

Analyze [6-(2-aminoethyl)naphthalen-2-yl]-(4-methylpiperazin-1-yl)methanone;2-amino-5-iodobenzoic acid;[6-[2-[(2-chloro-6-isocyanoquinazolin-4-yl)amino]ethyl]naphthalen-2-yl]-(4-methylpiperazin-1-yl)methanone;6-(cyanomethyl)naphthalene-2-carboxylic acid;2,4-dichloro-6-isocyanoquinazoline;6-iodo-1H-quinazoline-2,4-dione;[6-[2-[(6-isocyano-2-methoxyquinazolin-4-yl)amino]ethyl]naphthalen-2-yl]-(4-methylpiperazin-1-yl)methanone;6-isocyano-1H-quinazoline-2,4-dione;methyl 6-(cyanomethyl)naphthalene-2-carboxylate;2-[6-(4-methylpiperazine-1-carbonyl)naphthalen-2-yl]acetonitrile with MolForge

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Related Compounds

dimethyl 2-aminobenzene-1,4-dicarboxylate;dimethyl 2-(carbamoylamino)benzene-1,4-dicarboxylate;ethane;methyl 2-chloroquinazoline-7-carboxylate;methyl 2,4-dichloroquinazoline-7-carboxylate;methyl 2,4-dioxo-1H-quinazoline-7-carboxylate;methyl 2-methylquinazoline-7-carboxylate;2-methylquinazoline-7-carboxylic acid;1-(2-methylquinazolin-7-yl)ethanone;hydroiodide
CID 159035420
3-aminonaphthalene-2-carboxylic acid;4-chlorobenzaldehyde;4-chloro-2-[(E)-2-(4-chlorophenyl)ethenyl]benzo[g]quinazoline;N-[2-[(E)-2-(4-chlorophenyl)ethenyl]benzo[g]quinazolin-4-yl]-N',N'-diethylethane-1,2-diamine;N',N'-diethylethane-1,2-diamine;2-methyl-3H-benzo[g]quinazolin-4-one
CID 160617837
adamantane-1-carbonitrile;2-(1-adamantyl)-4-chloro-7-methylquinazoline;2-(1-adamantyl)-7-methyl-3H-quinazolin-4-one;2-(1-adamantyl)-7-methyl-4-[3-[2-(sulfamoylamino)ethyl]azetidin-1-yl]quinazoline;2-amino-4-methylbenzoic acid;methyl 2-amino-4-methylbenzoate;3-[2-(sulfamoylamino)ethyl]azetidine
CID 165005598

Frequently Asked Questions

What is the IUPAC name of [6-(2-aminoethyl)naphthalen-2-yl]-(4-methylpiperazin-1-yl)methanone;2-amino-5-iodobenzoic acid;[6-[2-[(2-chloro-6-isocyanoquinazolin-4-yl)amino]ethyl]naphthalen-2-yl]-(4-methylpiperazin-1-yl)methanone;6-(cyanomethyl)naphthalene-2-carboxylic acid;2,4-dichloro-6-isocyanoquinazoline;6-iodo-1H-quinazoline-2,4-dione;[6-[2-[(6-isocyano-2-methoxyquinazolin-4-yl)amino]ethyl]naphthalen-2-yl]-(4-methylpiperazin-1-yl)methanone;6-isocyano-1H-quinazoline-2,4-dione;methyl 6-(cyanomethyl)naphthalene-2-carboxylate;2-[6-(4-methylpiperazine-1-carbonyl)naphthalen-2-yl]acetonitrile?
The IUPAC name of [6-(2-aminoethyl)naphthalen-2-yl]-(4-methylpiperazin-1-yl)methanone;2-amino-5-iodobenzoic acid;[6-[2-[(2-chloro-6-isocyanoquinazolin-4-yl)amino]ethyl]naphthalen-2-yl]-(4-methylpiperazin-1-yl)methanone;6-(cyanomethyl)naphthalene-2-carboxylic acid;2,4-dichloro-6-isocyanoquinazoline;6-iodo-1H-quinazoline-2,4-dione;[6-[2-[(6-isocyano-2-methoxyquinazolin-4-yl)amino]ethyl]naphthalen-2-yl]-(4-methylpiperazin-1-yl)methanone;6-isocyano-1H-quinazoline-2,4-dione;methyl 6-(cyanomethyl)naphthalene-2-carboxylate;2-[6-(4-methylpiperazine-1-carbonyl)naphthalen-2-yl]acetonitrile (CID 165106231) is [6-(2-aminoethyl)naphthalen-2-yl]-(4-methylpiperazin-1-yl)methanone;2-amino-5-iodobenzoic acid;[6-[2-[(2-chloro-6-isocyanoquinazolin-4-yl)amino]ethyl]naphthalen-2-yl]-(4-methylpiperazin-1-yl)methanone;6-(cyanomethyl)naphthalene-2-carboxylic acid;2,4-dichloro-6-isocyanoquinazoline;6-iodo-1H-quinazoline-2,4-dione;[6-[2-[(6-isocyano-2-methoxyquinazolin-4-yl)amino]ethyl]naphthalen-2-yl]-(4-methylpiperazin-1-yl)methanone;6-isocyano-1H-quinazoline-2,4-dione;methyl 6-(cyanomethyl)naphthalene-2-carboxylate;2-[6-(4-methylpiperazine-1-carbonyl)naphthalen-2-yl]acetonitrile.
What is the SMILES notation for [6-(2-aminoethyl)naphthalen-2-yl]-(4-methylpiperazin-1-yl)methanone;2-amino-5-iodobenzoic acid;[6-[2-[(2-chloro-6-isocyanoquinazolin-4-yl)amino]ethyl]naphthalen-2-yl]-(4-methylpiperazin-1-yl)methanone;6-(cyanomethyl)naphthalene-2-carboxylic acid;2,4-dichloro-6-isocyanoquinazoline;6-iodo-1H-quinazoline-2,4-dione;[6-[2-[(6-isocyano-2-methoxyquinazolin-4-yl)amino]ethyl]naphthalen-2-yl]-(4-methylpiperazin-1-yl)methanone;6-isocyano-1H-quinazoline-2,4-dione;methyl 6-(cyanomethyl)naphthalene-2-carboxylate;2-[6-(4-methylpiperazine-1-carbonyl)naphthalen-2-yl]acetonitrile?
The canonical SMILES for [6-(2-aminoethyl)naphthalen-2-yl]-(4-methylpiperazin-1-yl)methanone;2-amino-5-iodobenzoic acid;[6-[2-[(2-chloro-6-isocyanoquinazolin-4-yl)amino]ethyl]naphthalen-2-yl]-(4-methylpiperazin-1-yl)methanone;6-(cyanomethyl)naphthalene-2-carboxylic acid;2,4-dichloro-6-isocyanoquinazoline;6-iodo-1H-quinazoline-2,4-dione;[6-[2-[(6-isocyano-2-methoxyquinazolin-4-yl)amino]ethyl]naphthalen-2-yl]-(4-methylpiperazin-1-yl)methanone;6-isocyano-1H-quinazoline-2,4-dione;methyl 6-(cyanomethyl)naphthalene-2-carboxylate;2-[6-(4-methylpiperazine-1-carbonyl)naphthalen-2-yl]acetonitrile is CN1CCN(C(=O)c2ccc3cc(CC#N)ccc3c2)CC1.CN1CCN(C(=O)c2ccc3cc(CCN)ccc3c2)CC1.COC(=O)c1ccc2cc(CC#N)ccc2c1.N#CCc1ccc2cc(C(=O)O)ccc2c1.Nc1ccc(I)cc1C(=O)O.O=c1[nH]c(=O)c2cc(I)ccc2[nH]1.[C-]#[N+]c1ccc2[nH]c(=O)[nH]c(=O)c2c1.[C-]#[N+]c1ccc2nc(Cl)nc(Cl)c2c1.[C-]#[N+]c1ccc2nc(Cl)nc(NCCc3ccc4cc(C(=O)N5CCN(C)CC5)ccc4c3)c2c1.[C-]#[N+]c1ccc2nc(OC)nc(NCCc3ccc4cc(C(=O)N5CCN(C)CC5)ccc4c3)c2c1.
What is the InChIKey of [6-(2-aminoethyl)naphthalen-2-yl]-(4-methylpiperazin-1-yl)methanone;2-amino-5-iodobenzoic acid;[6-[2-[(2-chloro-6-isocyanoquinazolin-4-yl)amino]ethyl]naphthalen-2-yl]-(4-methylpiperazin-1-yl)methanone;6-(cyanomethyl)naphthalene-2-carboxylic acid;2,4-dichloro-6-isocyanoquinazoline;6-iodo-1H-quinazoline-2,4-dione;[6-[2-[(6-isocyano-2-methoxyquinazolin-4-yl)amino]ethyl]naphthalen-2-yl]-(4-methylpiperazin-1-yl)methanone;6-isocyano-1H-quinazoline-2,4-dione;methyl 6-(cyanomethyl)naphthalene-2-carboxylate;2-[6-(4-methylpiperazine-1-carbonyl)naphthalen-2-yl]acetonitrile?
The InChIKey is ZECVSRQKPYTDOY-UHFFFAOYSA-N. The full InChI is InChI=1S/C28H28N6O2.C27H25ClN6O.C18H23N3O.C18H19N3O.C14H11NO2.C13H9NO2.C9H3Cl2N3.C9H5N3O2.C8H5IN2O2.C7H6INO2/c1-29-23-8-9-25-24(18-23)26(32-28(31-25)36-3)30-11-10-19-4-5-21-17-22(7-6-20(21)16-19)27(35)34-14-12-33(2)13-15-34;1-29-22-7-8-24-23(17-22)25(32-27(28)31-24)30-10-9-18-3-4-20-16-21(6-5-19(20)15-18)26(35)34-13-11-33(2)12-14-34;2*1-20-8-10-21(11-9-20)18(22)17-5-4-15-12-14(6-7-19)2-3-16(15)13-17;1-17-14(16)13-5-4-11-8-10(6-7-15)2-3-12(11)9-13;14-6-5-9-1-2-11-8-12(13(15)16)4-3-10(11)7-9;1-12-5-2-3-7-6(4-5)8(10)14-9(11)13-7;1-10-5-2-3-7-6(4-5)8(13)12-9(14)11-7;9-4-1-2-6-5(3-4)7(12)11-8(13)10-6;8-4-1-2-6(9)5(3-4)7(10)11/h4-9,16-18H,10-15H2,2-3H3,(H,30,31,32);3-8,15-17H,9-14H2,2H3,(H,30,31,32);2-5,12-13H,6-11,19H2,1H3;2-5,12-13H,6,8-11H2,1H3;2-5,8-9H,6H2,1H3;1-4,7-8H,5H2,(H,15,16);2-4H;2-4H,(H2,11,12,13,14);1-3H,(H2,10,11,12,13);1-3H,9H2,(H,10,11).
What are the key properties of [6-(2-aminoethyl)naphthalen-2-yl]-(4-methylpiperazin-1-yl)methanone;2-amino-5-iodobenzoic acid;[6-[2-[(2-chloro-6-isocyanoquinazolin-4-yl)amino]ethyl]naphthalen-2-yl]-(4-methylpiperazin-1-yl)methanone;6-(cyanomethyl)naphthalene-2-carboxylic acid;2,4-dichloro-6-isocyanoquinazoline;6-iodo-1H-quinazoline-2,4-dione;[6-[2-[(6-isocyano-2-methoxyquinazolin-4-yl)amino]ethyl]naphthalen-2-yl]-(4-methylpiperazin-1-yl)methanone;6-isocyano-1H-quinazoline-2,4-dione;methyl 6-(cyanomethyl)naphthalene-2-carboxylate;2-[6-(4-methylpiperazine-1-carbonyl)naphthalen-2-yl]acetonitrile?
[6-(2-aminoethyl)naphthalen-2-yl]-(4-methylpiperazin-1-yl)methanone;2-amino-5-iodobenzoic acid;[6-[2-[(2-chloro-6-isocyanoquinazolin-4-yl)amino]ethyl]naphthalen-2-yl]-(4-methylpiperazin-1-yl)methanone;6-(cyanomethyl)naphthalene-2-carboxylic acid;2,4-dichloro-6-isocyanoquinazoline;6-iodo-1H-quinazoline-2,4-dione;[6-[2-[(6-isocyano-2-methoxyquinazolin-4-yl)amino]ethyl]naphthalen-2-yl]-(4-methylpiperazin-1-yl)methanone;6-isocyano-1H-quinazoline-2,4-dione;methyl 6-(cyanomethyl)naphthalene-2-carboxylate;2-[6-(4-methylpiperazine-1-carbonyl)naphthalen-2-yl]acetonitrile has a molecular weight of 2955.09 g/mol, XLogP of 25.38, 21 rotatable bonds, 10 hydrogen bond donors, and 30 hydrogen bond acceptors.
Where does this data come from?
All data for [6-(2-aminoethyl)naphthalen-2-yl]-(4-methylpiperazin-1-yl)methanone;2-amino-5-iodobenzoic acid;[6-[2-[(2-chloro-6-isocyanoquinazolin-4-yl)amino]ethyl]naphthalen-2-yl]-(4-methylpiperazin-1-yl)methanone;6-(cyanomethyl)naphthalene-2-carboxylic acid;2,4-dichloro-6-isocyanoquinazoline;6-iodo-1H-quinazoline-2,4-dione;[6-[2-[(6-isocyano-2-methoxyquinazolin-4-yl)amino]ethyl]naphthalen-2-yl]-(4-methylpiperazin-1-yl)methanone;6-isocyano-1H-quinazoline-2,4-dione;methyl 6-(cyanomethyl)naphthalene-2-carboxylate;2-[6-(4-methylpiperazine-1-carbonyl)naphthalen-2-yl]acetonitrile is sourced from PubChem (CID 165106231), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).