2-amino-3-methoxybenzoic acid;tert-butyl N-[2-(azetidin-3-yl)ethyl]carbamate;tert-butyl N-[2-[1-(8-methoxyquinazolin-4-yl)azetidin-3-yl]ethyl]carbamate;tert-butyl N-[2-[1-(8-methoxyquinazolin-4-yl)azetidin-3-yl]ethylsulfamoyl]carbamate;4-chloro-8-methoxyquinazoline;N-[4-(dimethylamino)pyridin-1-ium-1-yl]sulfonyl-1-[(2-methylpropan-2-yl)oxy]methanimidate;8-methoxy-3H-quinazolin-4-one;2-[1-(8-methoxyquinazolin-4-yl)azetidin-3-yl]ethanamine;8-methoxy-4-[3-[2-(sulfamoylamino)ethyl]azetidin-1-yl]quinazoline;phosphoryl trichloride;2,2,2-trifluoroacetic acid;hydrochloride

C116H155Cl5F3N28O27PS3 — CID 165077232

IUPAC2-amino-3-methoxybenzoic acid;tert-butyl N-[2-(azetidin-3-yl)ethyl]carbamate;tert-butyl N-[2-[1-(8-methoxyquinazolin-4-yl)azetidin-3-yl]ethyl]carbamate;tert-butyl N-[2-[1-(8-methoxyquinazolin-4-yl)azetidin-3-yl]ethylsulfamoyl]carbamate;4-chloro-8-methoxyquinazoline;N-[4-(dimethylamino)pyridin-1-ium-1-yl]sulfonyl-1-[(2-methylpropan-2-yl)oxy]methanimidate;8-methoxy-3H-quinazolin-4-one;2-[1-(8-methoxyquinazolin-4-yl)azetidin-3-yl]ethanamine;8-methoxy-4-[3-[2-(sulfamoylamino)ethyl]azetidin-1-yl]quinazoline;phosphoryl trichloride;2,2,2-trifluoroacetic acid;hydrochloride
SMILESCC(C)(C)OC(=O)NCCC1CNC1.CN(C)c1cc[n+](S(=O)(=O)N=C([O-])OC(C)(C)C)cc1.COc1cccc(C(=O)O)c1N.COc1cccc2c(=O)[nH]cnc12.COc1cccc2c(Cl)ncnc12.COc1cccc2c(N3CC(CCN)C3)ncnc12.COc1cccc2c(N3CC(CCNC(=O)OC(C)(C)C)C3)ncnc12.COc1cccc2c(N3CC(CCNS(=O)(=O)NC(=O)OC(C)(C)C)C3)ncnc12.COc1cccc2c(N3CC(CCNS(N)(=O)=O)C3)ncnc12.Cl.O=C(O)C(F)(F)F.O=P(Cl)(Cl)Cl
InChIInChI=1S/C19H27N5O5S.C19H26N4O3.C14H19N5O3S.C14H18N4O.C12H19N3O4S.C10H20N2O2.C9H7ClN2O.C9H8N2O2.C8H9NO3.C2HF3O2.Cl3OP.ClH/c1-19(2,3)29-18(25)23-30(26,27)22-9-8-13-10-24(11-13)17-14-6-5-7-15(28-4)16(14)20-12-21-17;1-19(2,3)26-18(24)20-9-8-13-10-23(11-13)17-14-6-5-7-15(25-4)16(14)21-12-22-17;1-22-12-4-2-3-11-13(12)16-9-17-14(11)19-7-10(8-19)5-6-18-23(15,20)21;1-19-12-4-2-3-11-13(12)16-9-17-14(11)18-7-10(8-18)5-6-15;1-12(2,3)19-11(16)13-20(17,18)15-8-6-10(7-9-15)14(4)5;1-10(2,3)14-9(13)12-5-4-8-6-11-7-8;1-13-7-4-2-3-6-8(7)11-5-12-9(6)10;1-13-7-4-2-3-6-8(7)10-5-11-9(6)12;1-12-6-4-2-3-5(7(6)9)8(10)11;3-2(4,5)1(6)7;1-5(2,3)4;/h5-7,12-13,22H,8-11H2,1-4H3,(H,23,25);5-7,12-13H,8-11H2,1-4H3,(H,20,24);2-4,9-10,18H,5-8H2,1H3,(H2,15,20,21);2-4,9-10H,5-8,15H2,1H3;6-9H,1-5H3;8,11H,4-7H2,1-3H3,(H,12,13);2-5H,1H3;2-5H,1H3,(H,10,11,12);2-4H,9H2,1H3,(H,10,11);(H,6,7);;1H
InChIKeyBEUJIKKEJFFLTD-UHFFFAOYSA-N
MW2735.12 g/mol
LogP15.34
Rot. Bonds32

About 2-amino-3-methoxybenzoic acid;tert-butyl N-[2-(azetidin-3-yl)ethyl]carbamate;tert-butyl N-[2-[1-(8-methoxyquinazolin-4-yl)azetidin-3-yl]ethyl]carbamate;tert-butyl N-[2-[1-(8-methoxyquinazolin-4-yl)azetidin-3-yl]ethylsulfamoyl]carbamate;4-chloro-8-methoxyquinazoline;N-[4-(dimethylamino)pyridin-1-ium-1-yl]sulfonyl-1-[(2-methylpropan-2-yl)oxy]methanimidate;8-methoxy-3H-quinazolin-4-one;2-[1-(8-methoxyquinazolin-4-yl)azetidin-3-yl]ethanamine;8-methoxy-4-[3-[2-(sulfamoylamino)ethyl]azetidin-1-yl]quinazoline;phosphoryl trichloride;2,2,2-trifluoroacetic acid;hydrochloride

2-amino-3-methoxybenzoic acid;tert-butyl N-[2-(azetidin-3-yl)ethyl]carbamate;tert-butyl N-[2-[1-(8-methoxyquinazolin-4-yl)azetidin-3-yl]ethyl]carbamate;tert-butyl N-[2-[1-(8-methoxyquinazolin-4-yl)azetidin-3-yl]ethylsulfamoyl]carbamate;4-chloro-8-methoxyquinazoline;N-[4-(dimethylamino)pyridin-1-ium-1-yl]sulfonyl-1-[(2-methylpropan-2-yl)oxy]methanimidate;8-methoxy-3H-quinazolin-4-one;2-[1-(8-methoxyquinazolin-4-yl)azetidin-3-yl]ethanamine;8-methoxy-4-[3-[2-(sulfamoylamino)ethyl]azetidin-1-yl]quinazoline;phosphoryl trichloride;2,2,2-trifluoroacetic acid;hydrochloride (PubChem CID 165077232) has the molecular formula C116H155Cl5F3N28O27PS3 and a molecular weight of 2735.12 g/mol. Its IUPAC name is 2-amino-3-methoxybenzoic acid;tert-butyl N-[2-(azetidin-3-yl)ethyl]carbamate;tert-butyl N-[2-[1-(8-methoxyquinazolin-4-yl)azetidin-3-yl]ethyl]carbamate;tert-butyl N-[2-[1-(8-methoxyquinazolin-4-yl)azetidin-3-yl]ethylsulfamoyl]carbamate;4-chloro-8-methoxyquinazoline;N-[4-(dimethylamino)pyridin-1-ium-1-yl]sulfonyl-1-[(2-methylpropan-2-yl)oxy]methanimidate;8-methoxy-3H-quinazolin-4-one;2-[1-(8-methoxyquinazolin-4-yl)azetidin-3-yl]ethanamine;8-methoxy-4-[3-[2-(sulfamoylamino)ethyl]azetidin-1-yl]quinazoline;phosphoryl trichloride;2,2,2-trifluoroacetic acid;hydrochloride.

Molecular Properties

Compound Name2-amino-3-methoxybenzoic acid;tert-butyl N-[2-(azetidin-3-yl)ethyl]carbamate;tert-butyl N-[2-[1-(8-methoxyquinazolin-4-yl)azetidin-3-yl]ethyl]carbamate;tert-butyl N-[2-[1-(8-methoxyquinazolin-4-yl)azetidin-3-yl]ethylsulfamoyl]carbamate;4-chloro-8-methoxyquinazoline;N-[4-(dimethylamino)pyridin-1-ium-1-yl]sulfonyl-1-[(2-methylpropan-2-yl)oxy]methanimidate;8-methoxy-3H-quinazolin-4-one;2-[1-(8-methoxyquinazolin-4-yl)azetidin-3-yl]ethanamine;8-methoxy-4-[3-[2-(sulfamoylamino)ethyl]azetidin-1-yl]quinazoline;phosphoryl trichloride;2,2,2-trifluoroacetic acid;hydrochloride
PubChem CID165077232
Molecular FormulaC116H155Cl5F3N28O27PS3
Molecular Weight2735.12 g/mol
Exact Mass2730.89
IUPAC Name2-amino-3-methoxybenzoic acid;tert-butyl N-[2-(azetidin-3-yl)ethyl]carbamate;tert-butyl N-[2-[1-(8-methoxyquinazolin-4-yl)azetidin-3-yl]ethyl]carbamate;tert-butyl N-[2-[1-(8-methoxyquinazolin-4-yl)azetidin-3-yl]ethylsulfamoyl]carbamate;4-chloro-8-methoxyquinazoline;N-[4-(dimethylamino)pyridin-1-ium-1-yl]sulfonyl-1-[(2-methylpropan-2-yl)oxy]methanimidate;8-methoxy-3H-quinazolin-4-one;2-[1-(8-methoxyquinazolin-4-yl)azetidin-3-yl]ethanamine;8-methoxy-4-[3-[2-(sulfamoylamino)ethyl]azetidin-1-yl]quinazoline;phosphoryl trichloride;2,2,2-trifluoroacetic acid;hydrochloride
SMILESCC(C)(C)OC(=O)NCCC1CNC1.CN(C)c1cc[n+](S(=O)(=O)N=C([O-])OC(C)(C)C)cc1.COc1cccc(C(=O)O)c1N.COc1cccc2c(=O)[nH]cnc12.COc1cccc2c(Cl)ncnc12.COc1cccc2c(N3CC(CCN)C3)ncnc12.COc1cccc2c(N3CC(CCNC(=O)OC(C)(C)C)C3)ncnc12.COc1cccc2c(N3CC(CCNS(=O)(=O)NC(=O)OC(C)(C)C)C3)ncnc12.COc1cccc2c(N3CC(CCNS(N)(=O)=O)C3)ncnc12.Cl.O=C(O)C(F)(F)F.O=P(Cl)(Cl)Cl
InChIInChI=1S/C19H27N5O5S.C19H26N4O3.C14H19N5O3S.C14H18N4O.C12H19N3O4S.C10H20N2O2.C9H7ClN2O.C9H8N2O2.C8H9NO3.C2HF3O2.Cl3OP.ClH/c1-19(2,3)29-18(25)23-30(26,27)22-9-8-13-10-24(11-13)17-14-6-5-7-15(28-4)16(14)20-12-21-17;1-19(2,3)26-18(24)20-9-8-13-10-23(11-13)17-14-6-5-7-15(25-4)16(14)21-12-22-17;1-22-12-4-2-3-11-13(12)16-9-17-14(11)19-7-10(8-19)5-6-18-23(15,20)21;1-19-12-4-2-3-11-13(12)16-9-17-14(11)18-7-10(8-18)5-6-15;1-12(2,3)19-11(16)13-20(17,18)15-8-6-10(7-9-15)14(4)5;1-10(2,3)14-9(13)12-5-4-8-6-11-7-8;1-13-7-4-2-3-6-8(7)11-5-12-9(6)10;1-13-7-4-2-3-6-8(7)10-5-11-9(6)12;1-12-6-4-2-3-5(7(6)9)8(10)11;3-2(4,5)1(6)7;1-5(2,3)4;/h5-7,12-13,22H,8-11H2,1-4H3,(H,23,25);5-7,12-13H,8-11H2,1-4H3,(H,20,24);2-4,9-10,18H,5-8H2,1H3,(H2,15,20,21);2-4,9-10H,5-8,15H2,1H3;6-9H,1-5H3;8,11H,4-7H2,1-3H3,(H,12,13);2-5H,1H3;2-5H,1H3,(H,10,11,12);2-4H,9H2,1H3,(H,10,11);(H,6,7);;1H
InChIKeyBEUJIKKEJFFLTD-UHFFFAOYSA-N
XLogP15.34
TPSA727.22 Ų
H-Bond Donors12
H-Bond Acceptors44
Rotatable Bonds32
Heavy Atoms183
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5002735.12
LogP ≤ 515.34
H-Bond Donors ≤ 512
H-Bond Acceptors ≤ 1044

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'acyl_het_A(9)', 'substructure': 'N/A'}, {'alert_name': '>_2_ester_groups', 'substructure': 'N/A'}, {'alert_name': 'aniline', 'substructure': 'N/A'}, {'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'imine_2', 'substructure': 'N/A'}

Analyze 2-amino-3-methoxybenzoic acid;tert-butyl N-[2-(azetidin-3-yl)ethyl]carbamate;tert-butyl N-[2-[1-(8-methoxyquinazolin-4-yl)azetidin-3-yl]ethyl]carbamate;tert-butyl N-[2-[1-(8-methoxyquinazolin-4-yl)azetidin-3-yl]ethylsulfamoyl]carbamate;4-chloro-8-methoxyquinazoline;N-[4-(dimethylamino)pyridin-1-ium-1-yl]sulfonyl-1-[(2-methylpropan-2-yl)oxy]methanimidate;8-methoxy-3H-quinazolin-4-one;2-[1-(8-methoxyquinazolin-4-yl)azetidin-3-yl]ethanamine;8-methoxy-4-[3-[2-(sulfamoylamino)ethyl]azetidin-1-yl]quinazoline;phosphoryl trichloride;2,2,2-trifluoroacetic acid;hydrochloride with MolForge

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Related Compounds

1-(2-amino-3-hydroxyphenyl)ethanone;8-(3-aminoprop-1-en-2-yl)-N-methylquinazoline-4-carboxamide;bis(tert-butyl N-[2-[4-(methylcarbamoyl)quinazolin-8-yl]prop-2-enyl]carbamate);tert-butyl N-(2-methylprop-2-enyl)carbamate;4-chloro-6-(6-methyl-3-pyridinyl)pyrimidine;4,8-dimethylquinazoline;N,8-dimethylquinazoline-4-carboxamide;formamide;methane;N-methyl-8-[(2S)-1-[[6-(6-methyl-3-pyridinyl)pyrimidin-4-yl]amino]propan-2-yl]quinazoline-4-carboxamide;N-methyl-8-[3-[[6-(6-methyl-3-pyridinyl)pyrimidin-4-yl]amino]prop-1-en-2-yl]quinazoline-4-carboxamide;4-methylquinazolin-8-ol;sulfane;2,2,2-trifluoroacetate;1,1,1-trifluoro-N-phenyl-N-(trifluoromethylsulfonyl)methanesulfonamide
CID 160145482
tert-butyl N-[2-(azetidin-3-yl)ethyl]carbamate;tert-butyl N-[2-[1-(2-chloro-6,7-dimethylquinazolin-4-yl)azetidin-3-yl]ethyl]carbamate;tert-butyl N-[2-[1-(2-chloro-6,7-dimethylquinazolin-4-yl)azetidin-3-yl]ethylsulfamoyl]carbamate;2-[1-(2-chloro-6,7-dimethylquinazolin-4-yl)azetidin-3-yl]ethanamine;2,4-dichloro-6,7-dimethylquinazoline;N-[4-(dimethylamino)pyridin-1-ium-1-yl]sulfonyl-1-[(2-methylpropan-2-yl)oxy]methanimidate;6,7-dimethyl-2-oxo-4-[3-[2-(sulfamoylamino)ethyl]azetidin-1-yl]-1H-quinazoline;6,7-dimethyl-1H-quinazoline-2,4-dione;methyl 2-amino-4,5-dimethylbenzoate;phosphoryl trichloride;2,2,2-trifluoroacetic acid;urea;hydrochloride
CID 165094512
2-amino-3-methoxy-5-methylbenzoic acid;4-chloro-8-methoxy-6-methylquinazoline;8-methoxy-6-methyl-3H-quinazolin-4-one;8-methoxy-6-methyl-4-[3-[2-(sulfamoylamino)ethyl]azetidin-1-yl]quinazoline;3-[2-(sulfamoylamino)ethyl]azetidine
CID 165016789
tert-butyl N-[2-(azetidin-3-yl)ethyl]carbamate;tert-butyl N-[2-[1-(8-ethoxyquinazolin-4-yl)azetidin-3-yl]ethyl]carbamate;4-chloro-8-ethoxyquinazoline;diethoxymethoxyethane;8-ethoxy-3H-quinazolin-4-one;ethyl 2-amino-3-ethoxybenzoate;ethyl 3-ethoxy-2-nitrobenzoate;3-hydroxy-2-nitrobenzoic acid;phosphoryl trichloride;hydrochloride
CID 165044483
2-amino-5-fluoro-3-methoxybenzoic acid;4-chloro-6-fluoro-8-methoxyquinazoline;6-fluoro-8-methoxy-3H-quinazolin-4-one;6-fluoro-8-methoxy-4-[3-[2-(sulfamoylamino)ethyl]azetidin-1-yl]quinazoline;3-[2-(sulfamoylamino)ethyl]azetidine
CID 165047479

Frequently Asked Questions

What is the IUPAC name of 2-amino-3-methoxybenzoic acid;tert-butyl N-[2-(azetidin-3-yl)ethyl]carbamate;tert-butyl N-[2-[1-(8-methoxyquinazolin-4-yl)azetidin-3-yl]ethyl]carbamate;tert-butyl N-[2-[1-(8-methoxyquinazolin-4-yl)azetidin-3-yl]ethylsulfamoyl]carbamate;4-chloro-8-methoxyquinazoline;N-[4-(dimethylamino)pyridin-1-ium-1-yl]sulfonyl-1-[(2-methylpropan-2-yl)oxy]methanimidate;8-methoxy-3H-quinazolin-4-one;2-[1-(8-methoxyquinazolin-4-yl)azetidin-3-yl]ethanamine;8-methoxy-4-[3-[2-(sulfamoylamino)ethyl]azetidin-1-yl]quinazoline;phosphoryl trichloride;2,2,2-trifluoroacetic acid;hydrochloride?
The IUPAC name of 2-amino-3-methoxybenzoic acid;tert-butyl N-[2-(azetidin-3-yl)ethyl]carbamate;tert-butyl N-[2-[1-(8-methoxyquinazolin-4-yl)azetidin-3-yl]ethyl]carbamate;tert-butyl N-[2-[1-(8-methoxyquinazolin-4-yl)azetidin-3-yl]ethylsulfamoyl]carbamate;4-chloro-8-methoxyquinazoline;N-[4-(dimethylamino)pyridin-1-ium-1-yl]sulfonyl-1-[(2-methylpropan-2-yl)oxy]methanimidate;8-methoxy-3H-quinazolin-4-one;2-[1-(8-methoxyquinazolin-4-yl)azetidin-3-yl]ethanamine;8-methoxy-4-[3-[2-(sulfamoylamino)ethyl]azetidin-1-yl]quinazoline;phosphoryl trichloride;2,2,2-trifluoroacetic acid;hydrochloride (CID 165077232) is 2-amino-3-methoxybenzoic acid;tert-butyl N-[2-(azetidin-3-yl)ethyl]carbamate;tert-butyl N-[2-[1-(8-methoxyquinazolin-4-yl)azetidin-3-yl]ethyl]carbamate;tert-butyl N-[2-[1-(8-methoxyquinazolin-4-yl)azetidin-3-yl]ethylsulfamoyl]carbamate;4-chloro-8-methoxyquinazoline;N-[4-(dimethylamino)pyridin-1-ium-1-yl]sulfonyl-1-[(2-methylpropan-2-yl)oxy]methanimidate;8-methoxy-3H-quinazolin-4-one;2-[1-(8-methoxyquinazolin-4-yl)azetidin-3-yl]ethanamine;8-methoxy-4-[3-[2-(sulfamoylamino)ethyl]azetidin-1-yl]quinazoline;phosphoryl trichloride;2,2,2-trifluoroacetic acid;hydrochloride.
What is the SMILES notation for 2-amino-3-methoxybenzoic acid;tert-butyl N-[2-(azetidin-3-yl)ethyl]carbamate;tert-butyl N-[2-[1-(8-methoxyquinazolin-4-yl)azetidin-3-yl]ethyl]carbamate;tert-butyl N-[2-[1-(8-methoxyquinazolin-4-yl)azetidin-3-yl]ethylsulfamoyl]carbamate;4-chloro-8-methoxyquinazoline;N-[4-(dimethylamino)pyridin-1-ium-1-yl]sulfonyl-1-[(2-methylpropan-2-yl)oxy]methanimidate;8-methoxy-3H-quinazolin-4-one;2-[1-(8-methoxyquinazolin-4-yl)azetidin-3-yl]ethanamine;8-methoxy-4-[3-[2-(sulfamoylamino)ethyl]azetidin-1-yl]quinazoline;phosphoryl trichloride;2,2,2-trifluoroacetic acid;hydrochloride?
The canonical SMILES for 2-amino-3-methoxybenzoic acid;tert-butyl N-[2-(azetidin-3-yl)ethyl]carbamate;tert-butyl N-[2-[1-(8-methoxyquinazolin-4-yl)azetidin-3-yl]ethyl]carbamate;tert-butyl N-[2-[1-(8-methoxyquinazolin-4-yl)azetidin-3-yl]ethylsulfamoyl]carbamate;4-chloro-8-methoxyquinazoline;N-[4-(dimethylamino)pyridin-1-ium-1-yl]sulfonyl-1-[(2-methylpropan-2-yl)oxy]methanimidate;8-methoxy-3H-quinazolin-4-one;2-[1-(8-methoxyquinazolin-4-yl)azetidin-3-yl]ethanamine;8-methoxy-4-[3-[2-(sulfamoylamino)ethyl]azetidin-1-yl]quinazoline;phosphoryl trichloride;2,2,2-trifluoroacetic acid;hydrochloride is CC(C)(C)OC(=O)NCCC1CNC1.CN(C)c1cc[n+](S(=O)(=O)N=C([O-])OC(C)(C)C)cc1.COc1cccc(C(=O)O)c1N.COc1cccc2c(=O)[nH]cnc12.COc1cccc2c(Cl)ncnc12.COc1cccc2c(N3CC(CCN)C3)ncnc12.COc1cccc2c(N3CC(CCNC(=O)OC(C)(C)C)C3)ncnc12.COc1cccc2c(N3CC(CCNS(=O)(=O)NC(=O)OC(C)(C)C)C3)ncnc12.COc1cccc2c(N3CC(CCNS(N)(=O)=O)C3)ncnc12.Cl.O=C(O)C(F)(F)F.O=P(Cl)(Cl)Cl.
What is the InChIKey of 2-amino-3-methoxybenzoic acid;tert-butyl N-[2-(azetidin-3-yl)ethyl]carbamate;tert-butyl N-[2-[1-(8-methoxyquinazolin-4-yl)azetidin-3-yl]ethyl]carbamate;tert-butyl N-[2-[1-(8-methoxyquinazolin-4-yl)azetidin-3-yl]ethylsulfamoyl]carbamate;4-chloro-8-methoxyquinazoline;N-[4-(dimethylamino)pyridin-1-ium-1-yl]sulfonyl-1-[(2-methylpropan-2-yl)oxy]methanimidate;8-methoxy-3H-quinazolin-4-one;2-[1-(8-methoxyquinazolin-4-yl)azetidin-3-yl]ethanamine;8-methoxy-4-[3-[2-(sulfamoylamino)ethyl]azetidin-1-yl]quinazoline;phosphoryl trichloride;2,2,2-trifluoroacetic acid;hydrochloride?
The InChIKey is BEUJIKKEJFFLTD-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H27N5O5S.C19H26N4O3.C14H19N5O3S.C14H18N4O.C12H19N3O4S.C10H20N2O2.C9H7ClN2O.C9H8N2O2.C8H9NO3.C2HF3O2.Cl3OP.ClH/c1-19(2,3)29-18(25)23-30(26,27)22-9-8-13-10-24(11-13)17-14-6-5-7-15(28-4)16(14)20-12-21-17;1-19(2,3)26-18(24)20-9-8-13-10-23(11-13)17-14-6-5-7-15(25-4)16(14)21-12-22-17;1-22-12-4-2-3-11-13(12)16-9-17-14(11)19-7-10(8-19)5-6-18-23(15,20)21;1-19-12-4-2-3-11-13(12)16-9-17-14(11)18-7-10(8-18)5-6-15;1-12(2,3)19-11(16)13-20(17,18)15-8-6-10(7-9-15)14(4)5;1-10(2,3)14-9(13)12-5-4-8-6-11-7-8;1-13-7-4-2-3-6-8(7)11-5-12-9(6)10;1-13-7-4-2-3-6-8(7)10-5-11-9(6)12;1-12-6-4-2-3-5(7(6)9)8(10)11;3-2(4,5)1(6)7;1-5(2,3)4;/h5-7,12-13,22H,8-11H2,1-4H3,(H,23,25);5-7,12-13H,8-11H2,1-4H3,(H,20,24);2-4,9-10,18H,5-8H2,1H3,(H2,15,20,21);2-4,9-10H,5-8,15H2,1H3;6-9H,1-5H3;8,11H,4-7H2,1-3H3,(H,12,13);2-5H,1H3;2-5H,1H3,(H,10,11,12);2-4H,9H2,1H3,(H,10,11);(H,6,7);;1H.
What are the key properties of 2-amino-3-methoxybenzoic acid;tert-butyl N-[2-(azetidin-3-yl)ethyl]carbamate;tert-butyl N-[2-[1-(8-methoxyquinazolin-4-yl)azetidin-3-yl]ethyl]carbamate;tert-butyl N-[2-[1-(8-methoxyquinazolin-4-yl)azetidin-3-yl]ethylsulfamoyl]carbamate;4-chloro-8-methoxyquinazoline;N-[4-(dimethylamino)pyridin-1-ium-1-yl]sulfonyl-1-[(2-methylpropan-2-yl)oxy]methanimidate;8-methoxy-3H-quinazolin-4-one;2-[1-(8-methoxyquinazolin-4-yl)azetidin-3-yl]ethanamine;8-methoxy-4-[3-[2-(sulfamoylamino)ethyl]azetidin-1-yl]quinazoline;phosphoryl trichloride;2,2,2-trifluoroacetic acid;hydrochloride?
2-amino-3-methoxybenzoic acid;tert-butyl N-[2-(azetidin-3-yl)ethyl]carbamate;tert-butyl N-[2-[1-(8-methoxyquinazolin-4-yl)azetidin-3-yl]ethyl]carbamate;tert-butyl N-[2-[1-(8-methoxyquinazolin-4-yl)azetidin-3-yl]ethylsulfamoyl]carbamate;4-chloro-8-methoxyquinazoline;N-[4-(dimethylamino)pyridin-1-ium-1-yl]sulfonyl-1-[(2-methylpropan-2-yl)oxy]methanimidate;8-methoxy-3H-quinazolin-4-one;2-[1-(8-methoxyquinazolin-4-yl)azetidin-3-yl]ethanamine;8-methoxy-4-[3-[2-(sulfamoylamino)ethyl]azetidin-1-yl]quinazoline;phosphoryl trichloride;2,2,2-trifluoroacetic acid;hydrochloride has a molecular weight of 2735.12 g/mol, XLogP of 15.34, 32 rotatable bonds, 12 hydrogen bond donors, and 44 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-3-methoxybenzoic acid;tert-butyl N-[2-(azetidin-3-yl)ethyl]carbamate;tert-butyl N-[2-[1-(8-methoxyquinazolin-4-yl)azetidin-3-yl]ethyl]carbamate;tert-butyl N-[2-[1-(8-methoxyquinazolin-4-yl)azetidin-3-yl]ethylsulfamoyl]carbamate;4-chloro-8-methoxyquinazoline;N-[4-(dimethylamino)pyridin-1-ium-1-yl]sulfonyl-1-[(2-methylpropan-2-yl)oxy]methanimidate;8-methoxy-3H-quinazolin-4-one;2-[1-(8-methoxyquinazolin-4-yl)azetidin-3-yl]ethanamine;8-methoxy-4-[3-[2-(sulfamoylamino)ethyl]azetidin-1-yl]quinazoline;phosphoryl trichloride;2,2,2-trifluoroacetic acid;hydrochloride is sourced from PubChem (CID 165077232), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).