4-[2-amino-5-methoxy-4-[3-(4-methylpiperazin-1-yl)propoxy]benzenecarboximidoyl]-N-(4-propan-2-yloxyphenyl)piperazine-1-carboxamide;2-(2-chloro-4-iodo-5-methylanilino)-N-(cyclopropylmethoxy)-3,4-difluorobenzamide;2-(2-chloro-4-methylanilino)-N-(cyclopropylmethoxy)-3,4-difluorobenzamide;4-(6-methoxy-7-methylquinazolin-4-yl)-N-(4-propan-2-yloxyphenyl)piperazine-1-carboxamide;4-(7-methoxy-6-methylquinazolin-4-yl)-N-(4-propan-2-yloxyphenyl)piperazine-1-carboxamide

C114H136Cl2F4IN21O14 — CID 157264028

IUPAC4-[2-amino-5-methoxy-4-[3-(4-methylpiperazin-1-yl)propoxy]benzenecarboximidoyl]-N-(4-propan-2-yloxyphenyl)piperazine-1-carboxamide;2-(2-chloro-4-iodo-5-methylanilino)-N-(cyclopropylmethoxy)-3,4-difluorobenzamide;2-(2-chloro-4-methylanilino)-N-(cyclopropylmethoxy)-3,4-difluorobenzamide;4-(6-methoxy-7-methylquinazolin-4-yl)-N-(4-propan-2-yloxyphenyl)piperazine-1-carboxamide;4-(7-methoxy-6-methylquinazolin-4-yl)-N-(4-propan-2-yloxyphenyl)piperazine-1-carboxamide
SMILESCOc1cc2c(N3CCN(C(=O)Nc4ccc(OC(C)C)cc4)CC3)ncnc2cc1C.COc1cc2ncnc(N3CCN(C(=O)Nc4ccc(OC(C)C)cc4)CC3)c2cc1C.Cc1cc(Nc2c(C(=O)NOCC3CC3)ccc(F)c2F)c(Cl)cc1I.Cc1ccc(Nc2c(C(=O)NOCC3CC3)ccc(F)c2F)c(Cl)c1.[H]/N=C(/c1cc(OC)c(OCCCN2CCN(C)CC2)cc1N)N1CCN(C(=O)Nc2ccc(OC(C)C)cc2)CC1
InChIInChI=1S/C30H45N7O4.2C24H29N5O3.C18H16ClF2IN2O2.C18H17ClF2N2O2/c1-22(2)41-24-8-6-23(7-9-24)33-30(38)37-17-15-36(16-18-37)29(32)25-20-27(39-4)28(21-26(25)31)40-19-5-10-35-13-11-34(3)12-14-35;1-16(2)32-19-7-5-18(6-8-19)27-24(30)29-11-9-28(10-12-29)23-20-14-22(31-4)17(3)13-21(20)25-15-26-23;1-16(2)32-19-7-5-18(6-8-19)27-24(30)29-11-9-28(10-12-29)23-20-13-17(3)22(31-4)14-21(20)25-15-26-23;1-9-6-15(12(19)7-14(9)22)23-17-11(4-5-13(20)16(17)21)18(25)24-26-8-10-2-3-10;1-10-2-7-15(13(19)8-10)22-17-12(5-6-14(20)16(17)21)18(24)23-25-9-11-3-4-11/h6-9,20-22,32H,5,10-19,31H2,1-4H3,(H,33,38);2*5-8,13-16H,9-12H2,1-4H3,(H,27,30);4-7,10,23H,2-3,8H2,1H3,(H,24,25);2,5-8,11,22H,3-4,9H2,1H3,(H,23,24)/b32-29-;;;;
InChIKeyAXUFQQUXWHPQFV-WAAXXEHPSA-N
MW2298.28 g/mol
LogP21.52
Rot. Bonds32

About 4-[2-amino-5-methoxy-4-[3-(4-methylpiperazin-1-yl)propoxy]benzenecarboximidoyl]-N-(4-propan-2-yloxyphenyl)piperazine-1-carboxamide;2-(2-chloro-4-iodo-5-methylanilino)-N-(cyclopropylmethoxy)-3,4-difluorobenzamide;2-(2-chloro-4-methylanilino)-N-(cyclopropylmethoxy)-3,4-difluorobenzamide;4-(6-methoxy-7-methylquinazolin-4-yl)-N-(4-propan-2-yloxyphenyl)piperazine-1-carboxamide;4-(7-methoxy-6-methylquinazolin-4-yl)-N-(4-propan-2-yloxyphenyl)piperazine-1-carboxamide

4-[2-amino-5-methoxy-4-[3-(4-methylpiperazin-1-yl)propoxy]benzenecarboximidoyl]-N-(4-propan-2-yloxyphenyl)piperazine-1-carboxamide;2-(2-chloro-4-iodo-5-methylanilino)-N-(cyclopropylmethoxy)-3,4-difluorobenzamide;2-(2-chloro-4-methylanilino)-N-(cyclopropylmethoxy)-3,4-difluorobenzamide;4-(6-methoxy-7-methylquinazolin-4-yl)-N-(4-propan-2-yloxyphenyl)piperazine-1-carboxamide;4-(7-methoxy-6-methylquinazolin-4-yl)-N-(4-propan-2-yloxyphenyl)piperazine-1-carboxamide (PubChem CID 157264028) has the molecular formula C114H136Cl2F4IN21O14 and a molecular weight of 2298.28 g/mol. Its IUPAC name is 4-[2-amino-5-methoxy-4-[3-(4-methylpiperazin-1-yl)propoxy]benzenecarboximidoyl]-N-(4-propan-2-yloxyphenyl)piperazine-1-carboxamide;2-(2-chloro-4-iodo-5-methylanilino)-N-(cyclopropylmethoxy)-3,4-difluorobenzamide;2-(2-chloro-4-methylanilino)-N-(cyclopropylmethoxy)-3,4-difluorobenzamide;4-(6-methoxy-7-methylquinazolin-4-yl)-N-(4-propan-2-yloxyphenyl)piperazine-1-carboxamide;4-(7-methoxy-6-methylquinazolin-4-yl)-N-(4-propan-2-yloxyphenyl)piperazine-1-carboxamide.

Molecular Properties

Compound Name4-[2-amino-5-methoxy-4-[3-(4-methylpiperazin-1-yl)propoxy]benzenecarboximidoyl]-N-(4-propan-2-yloxyphenyl)piperazine-1-carboxamide;2-(2-chloro-4-iodo-5-methylanilino)-N-(cyclopropylmethoxy)-3,4-difluorobenzamide;2-(2-chloro-4-methylanilino)-N-(cyclopropylmethoxy)-3,4-difluorobenzamide;4-(6-methoxy-7-methylquinazolin-4-yl)-N-(4-propan-2-yloxyphenyl)piperazine-1-carboxamide;4-(7-methoxy-6-methylquinazolin-4-yl)-N-(4-propan-2-yloxyphenyl)piperazine-1-carboxamide
PubChem CID157264028
Molecular FormulaC114H136Cl2F4IN21O14
Molecular Weight2298.28 g/mol
Exact Mass2295.89
IUPAC Name4-[2-amino-5-methoxy-4-[3-(4-methylpiperazin-1-yl)propoxy]benzenecarboximidoyl]-N-(4-propan-2-yloxyphenyl)piperazine-1-carboxamide;2-(2-chloro-4-iodo-5-methylanilino)-N-(cyclopropylmethoxy)-3,4-difluorobenzamide;2-(2-chloro-4-methylanilino)-N-(cyclopropylmethoxy)-3,4-difluorobenzamide;4-(6-methoxy-7-methylquinazolin-4-yl)-N-(4-propan-2-yloxyphenyl)piperazine-1-carboxamide;4-(7-methoxy-6-methylquinazolin-4-yl)-N-(4-propan-2-yloxyphenyl)piperazine-1-carboxamide
SMILESCOc1cc2c(N3CCN(C(=O)Nc4ccc(OC(C)C)cc4)CC3)ncnc2cc1C.COc1cc2ncnc(N3CCN(C(=O)Nc4ccc(OC(C)C)cc4)CC3)c2cc1C.Cc1cc(Nc2c(C(=O)NOCC3CC3)ccc(F)c2F)c(Cl)cc1I.Cc1ccc(Nc2c(C(=O)NOCC3CC3)ccc(F)c2F)c(Cl)c1.[H]/N=C(/c1cc(OC)c(OCCCN2CCN(C)CC2)cc1N)N1CCN(C(=O)Nc2ccc(OC(C)C)cc2)CC1
InChIInChI=1S/C30H45N7O4.2C24H29N5O3.C18H16ClF2IN2O2.C18H17ClF2N2O2/c1-22(2)41-24-8-6-23(7-9-24)33-30(38)37-17-15-36(16-18-37)29(32)25-20-27(39-4)28(21-26(25)31)40-19-5-10-35-13-11-34(3)12-14-35;1-16(2)32-19-7-5-18(6-8-19)27-24(30)29-11-9-28(10-12-29)23-20-14-22(31-4)17(3)13-21(20)25-15-26-23;1-16(2)32-19-7-5-18(6-8-19)27-24(30)29-11-9-28(10-12-29)23-20-13-17(3)22(31-4)14-21(20)25-15-26-23;1-9-6-15(12(19)7-14(9)22)23-17-11(4-5-13(20)16(17)21)18(25)24-26-8-10-2-3-10;1-10-2-7-15(13(19)8-10)22-17-12(5-6-14(20)16(17)21)18(24)23-25-9-11-3-4-11/h6-9,20-22,32H,5,10-19,31H2,1-4H3,(H,33,38);2*5-8,13-16H,9-12H2,1-4H3,(H,27,30);4-7,10,23H,2-3,8H2,1H3,(H,24,25);2,5-8,11,22H,3-4,9H2,1H3,(H,23,24)/b32-29-;;;;
InChIKeyAXUFQQUXWHPQFV-WAAXXEHPSA-N
XLogP21.52
TPSA379.98 Ų
H-Bond Donors9
H-Bond Acceptors26
Rotatable Bonds32
Heavy Atoms156
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5002298.28
LogP ≤ 521.52
H-Bond Donors ≤ 59
H-Bond Acceptors ≤ 1026

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'aniline', 'substructure': 'N/A'}, {'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'imine_2', 'substructure': 'N/A'}, {'alert_name': 'iodine', 'substructure': 'N/A'}

Analyze 4-[2-amino-5-methoxy-4-[3-(4-methylpiperazin-1-yl)propoxy]benzenecarboximidoyl]-N-(4-propan-2-yloxyphenyl)piperazine-1-carboxamide;2-(2-chloro-4-iodo-5-methylanilino)-N-(cyclopropylmethoxy)-3,4-difluorobenzamide;2-(2-chloro-4-methylanilino)-N-(cyclopropylmethoxy)-3,4-difluorobenzamide;4-(6-methoxy-7-methylquinazolin-4-yl)-N-(4-propan-2-yloxyphenyl)piperazine-1-carboxamide;4-(7-methoxy-6-methylquinazolin-4-yl)-N-(4-propan-2-yloxyphenyl)piperazine-1-carboxamide with MolForge

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Related Compounds

4-[2-(3-amino-6-chloroisoquinolin-4-yl)ethynyl]-N-[4-[[4-[[3-[2-(6,7-dimethoxyquinazolin-4-yl)ethynyl]-2-methyl-5-[[4-[(4-methylpiperazin-1-yl)methyl]-3-(trifluoromethyl)phenyl]carbamoyl]phenyl]methyl]piperazin-1-yl]methyl]-3-(trifluoromethyl)phenyl]-5-methylpyridine-2-carboxamide
CID 134276736
4-[2-(3-amino-6-chloroisoquinolin-4-yl)ethynyl]-5-methyl-N-[4-[(4-methylpiperazin-1-yl)methyl]-3-(trifluoromethyl)phenyl]pyridine-2-carboxamide;3-[2-(6,7-dimethoxyquinazolin-4-yl)ethynyl]-4-methyl-N-[4-[(4-methylpiperazin-1-yl)methyl]-3-(trifluoromethyl)phenyl]benzamide
CID 142291242
3-[2-(2-amino-6,7-dimethoxyquinazolin-4-yl)ethynyl]-N-[[4-[2-(dimethylamino)ethoxy]phenyl]methyl]-4-methylbenzamide;3-[2-(2-amino-6,7-dimethoxyquinazolin-4-yl)ethynyl]-4-methyl-N-[4-[(4-methylpiperazin-1-yl)methyl]-3-(trifluoromethyl)phenyl]benzamide;1-[3-[2-(2-aminoquinolin-4-yl)ethynyl]phenyl]-3-[4-methyl-3-(trifluoromethyl)phenyl]propan-2-one;1-[4-[2-[6-chloro-3-(2-cyclopropyl-2-oxoethyl)isoquinolin-4-yl]ethynyl]phenyl]-4-piperidin-1-ylbutan-1-one;methane
CID 157673707
3-[2-(2-amino-6,7-dimethoxyquinazolin-4-yl)ethynyl]-4-methyl-N-[4-[(4-methylpiperazin-1-yl)methyl]-3-(trifluoromethyl)phenyl]benzamide;3-[2-(8-amino-1,7-naphthyridin-5-yl)ethynyl]-4-methyl-N-[4-[(4-methylpiperazin-1-yl)methyl]-3-(trifluoromethyl)phenyl]benzamide;1-[3-[2-(2-aminoquinolin-4-yl)ethynyl]phenyl]-3-[4-methyl-3-(trifluoromethyl)phenyl]propan-2-one;1-[4-[2-[6-chloro-3-(2-cyclopropyl-2-oxoethyl)isoquinolin-4-yl]ethynyl]phenyl]-4-piperidin-1-ylbutan-1-one
CID 161635436
1-[5-[9-[[4-[4-[4-[[(1R)-1-[3-amino-5-(trifluoromethyl)phenyl]ethyl]amino]-7-methoxy-2-methylquinazolin-6-yl]oxypiperidine-1-carbonyl]piperidin-1-yl]methyl]-3-azaspiro[5.5]undecane-3-carbonyl]-2-chlorophenyl]-1,3-diazinane-2,4-dione
CID 166066258
1-[5-[9-[[4-[4-[4-[[3-Amino-5-(trifluoromethyl)phenyl]methylamino]-7-methoxy-2-methylquinazolin-6-yl]oxypiperidine-1-carbonyl]piperidin-1-yl]methyl]-3-azaspiro[5.5]undecane-3-carbonyl]-2-chlorophenyl]-1,3-diazinane-2,4-dione
CID 174198182
1-[5-[9-[[4-[4-[4-[1-[3-Amino-5-(trifluoromethyl)phenyl]ethylamino]-7-methoxy-2-methylquinazolin-6-yl]oxypiperidine-1-carbonyl]piperidin-1-yl]methyl]-3-azaspiro[5.5]undecane-3-carbonyl]-2-chlorophenyl]-1,3-diazinane-2,4-dione
CID 174208558
6-[[(1S,5R)-3-acetyl-3-azabicyclo[3.1.1]heptan-6-yl]oxy]-7-methoxy-3H-quinazolin-4-one;6-[[(1S,5R)-3-azabicyclo[3.1.1]heptan-6-yl]oxy]-N-(3-chloro-4-fluorophenyl)-7-methoxyquinazolin-4-amine;1-[(1S,5R)-6-[4-(3-chloro-4-fluoroanilino)-7-methoxyquinazolin-6-yl]oxy-3-azabicyclo[3.1.1]heptan-3-yl]ethanone;1-[(1S,5R)-6-[4-(3-chloro-4-fluoroanilino)-7-methoxyquinazolin-6-yl]oxy-3-azabicyclo[3.1.1]heptan-3-yl]prop-2-en-1-one
CID 157312999
4-[2-amino-5-methoxy-4-[3-(4-methylpiperazin-1-yl)propoxy]benzenecarboximidoyl]-N-(4-propan-2-yloxyphenyl)piperazine-1-carboxamide;1-[3-tert-butyl-1-(2,4-dimethylphenyl)pyrazol-5-yl]-3-[4-(2-morpholin-4-ylethoxy)naphthalen-1-yl]urea;1-[3-tert-butyl-1-(3,4-dimethylphenyl)pyrazol-5-yl]-3-[4-(2-morpholin-4-ylethoxy)naphthalen-1-yl]urea;2-(2-chloro-4-iodo-5-methylanilino)-N-(cyclopropylmethoxy)-3,4-difluorobenzamide;2-(2-chloro-4-methylanilino)-N-(cyclopropylmethoxy)-3,4-difluorobenzamide;4-(7-methoxy-6-methylquinazolin-4-yl)-N-(4-propan-2-yloxyphenyl)piperazine-1-carboxamide
CID 157652172
6-[(R)-amino-(4-chlorophenyl)-(3-methylimidazol-4-yl)methyl]-4-(3-chlorophenyl)-1-methylquinolin-2-one;2-(2-chloro-4-iodo-5-methylanilino)-N-(cyclopropylmethoxy)-3,4-difluorobenzamide;2-(2-chloro-4-methylanilino)-N-(cyclopropylmethoxy)-3,4-difluorobenzamide;4-[6-methoxy-7-[3-(4-methylpiperazin-1-yl)propoxy]quinazolin-4-yl]-N-(4-propan-2-yloxyphenyl)piperazine-1-carboxamide;4-(6-methoxy-7-methylquinazolin-4-yl)-N-(4-propan-2-yloxyphenyl)piperazine-1-carboxamide;4-(7-methoxy-6-methylquinazolin-4-yl)-N-(4-propan-2-yloxyphenyl)piperazine-1-carboxamide
CID 157870944
6,7-bis(2-methoxyethoxy)-N-(3-prop-1-ynylphenyl)quinazolin-4-amine;N-(3-chloro-4-fluorophenyl)-7-methoxy-6-propoxyquinazolin-4-amine;ethane;N-(3-ethynylphenyl)-6,7-bis(2-methoxyethoxy)quinazolin-4-amine;N-(3-ethynylphenyl)-6-(2-methoxyethoxy)-7-propoxyquinazolin-4-amine;N-(3-ethynylphenyl)-7-(2-methoxyethoxy)-6-propoxyquinazolin-4-amine;4-[1-(4-methylpiperazin-1-yl)ethyl]-N-[4-methyl-3-[(4-pyridin-3-ylpyrimidin-2-yl)amino]phenyl]benzamide;bis(4-[(4-methylpiperazin-1-yl)methyl]-N-[4-methyl-3-[(4-pyridin-3-ylpyrimidin-2-yl)amino]phenyl]benzamide)
CID 158445760
bis(6-[(R)-amino-(4-chlorophenyl)-(3-methylimidazol-4-yl)methyl]-4-(3-chlorophenyl)-1-methylquinolin-2-one);2-(2-chloro-4-iodo-5-methylanilino)-N-(cyclopropylmethoxy)-3,4-difluorobenzamide;2-(2-chloro-4-methylanilino)-N-(cyclopropylmethoxy)-3,4-difluorobenzamide;4-[6-methoxy-7-[3-(4-methylpiperazin-1-yl)propoxy]quinazolin-4-yl]-N-(4-propan-2-yloxyphenyl)piperazine-1-carboxamide;4-(7-methoxy-6-methylquinazolin-4-yl)-N-(4-propan-2-yloxyphenyl)piperazine-1-carboxamide
CID 158530148

Frequently Asked Questions

What is the IUPAC name of 4-[2-amino-5-methoxy-4-[3-(4-methylpiperazin-1-yl)propoxy]benzenecarboximidoyl]-N-(4-propan-2-yloxyphenyl)piperazine-1-carboxamide;2-(2-chloro-4-iodo-5-methylanilino)-N-(cyclopropylmethoxy)-3,4-difluorobenzamide;2-(2-chloro-4-methylanilino)-N-(cyclopropylmethoxy)-3,4-difluorobenzamide;4-(6-methoxy-7-methylquinazolin-4-yl)-N-(4-propan-2-yloxyphenyl)piperazine-1-carboxamide;4-(7-methoxy-6-methylquinazolin-4-yl)-N-(4-propan-2-yloxyphenyl)piperazine-1-carboxamide?
The IUPAC name of 4-[2-amino-5-methoxy-4-[3-(4-methylpiperazin-1-yl)propoxy]benzenecarboximidoyl]-N-(4-propan-2-yloxyphenyl)piperazine-1-carboxamide;2-(2-chloro-4-iodo-5-methylanilino)-N-(cyclopropylmethoxy)-3,4-difluorobenzamide;2-(2-chloro-4-methylanilino)-N-(cyclopropylmethoxy)-3,4-difluorobenzamide;4-(6-methoxy-7-methylquinazolin-4-yl)-N-(4-propan-2-yloxyphenyl)piperazine-1-carboxamide;4-(7-methoxy-6-methylquinazolin-4-yl)-N-(4-propan-2-yloxyphenyl)piperazine-1-carboxamide (CID 157264028) is 4-[2-amino-5-methoxy-4-[3-(4-methylpiperazin-1-yl)propoxy]benzenecarboximidoyl]-N-(4-propan-2-yloxyphenyl)piperazine-1-carboxamide;2-(2-chloro-4-iodo-5-methylanilino)-N-(cyclopropylmethoxy)-3,4-difluorobenzamide;2-(2-chloro-4-methylanilino)-N-(cyclopropylmethoxy)-3,4-difluorobenzamide;4-(6-methoxy-7-methylquinazolin-4-yl)-N-(4-propan-2-yloxyphenyl)piperazine-1-carboxamide;4-(7-methoxy-6-methylquinazolin-4-yl)-N-(4-propan-2-yloxyphenyl)piperazine-1-carboxamide.
What is the SMILES notation for 4-[2-amino-5-methoxy-4-[3-(4-methylpiperazin-1-yl)propoxy]benzenecarboximidoyl]-N-(4-propan-2-yloxyphenyl)piperazine-1-carboxamide;2-(2-chloro-4-iodo-5-methylanilino)-N-(cyclopropylmethoxy)-3,4-difluorobenzamide;2-(2-chloro-4-methylanilino)-N-(cyclopropylmethoxy)-3,4-difluorobenzamide;4-(6-methoxy-7-methylquinazolin-4-yl)-N-(4-propan-2-yloxyphenyl)piperazine-1-carboxamide;4-(7-methoxy-6-methylquinazolin-4-yl)-N-(4-propan-2-yloxyphenyl)piperazine-1-carboxamide?
The canonical SMILES for 4-[2-amino-5-methoxy-4-[3-(4-methylpiperazin-1-yl)propoxy]benzenecarboximidoyl]-N-(4-propan-2-yloxyphenyl)piperazine-1-carboxamide;2-(2-chloro-4-iodo-5-methylanilino)-N-(cyclopropylmethoxy)-3,4-difluorobenzamide;2-(2-chloro-4-methylanilino)-N-(cyclopropylmethoxy)-3,4-difluorobenzamide;4-(6-methoxy-7-methylquinazolin-4-yl)-N-(4-propan-2-yloxyphenyl)piperazine-1-carboxamide;4-(7-methoxy-6-methylquinazolin-4-yl)-N-(4-propan-2-yloxyphenyl)piperazine-1-carboxamide is COc1cc2c(N3CCN(C(=O)Nc4ccc(OC(C)C)cc4)CC3)ncnc2cc1C.COc1cc2ncnc(N3CCN(C(=O)Nc4ccc(OC(C)C)cc4)CC3)c2cc1C.Cc1cc(Nc2c(C(=O)NOCC3CC3)ccc(F)c2F)c(Cl)cc1I.Cc1ccc(Nc2c(C(=O)NOCC3CC3)ccc(F)c2F)c(Cl)c1.[H]/N=C(/c1cc(OC)c(OCCCN2CCN(C)CC2)cc1N)N1CCN(C(=O)Nc2ccc(OC(C)C)cc2)CC1.
What is the InChIKey of 4-[2-amino-5-methoxy-4-[3-(4-methylpiperazin-1-yl)propoxy]benzenecarboximidoyl]-N-(4-propan-2-yloxyphenyl)piperazine-1-carboxamide;2-(2-chloro-4-iodo-5-methylanilino)-N-(cyclopropylmethoxy)-3,4-difluorobenzamide;2-(2-chloro-4-methylanilino)-N-(cyclopropylmethoxy)-3,4-difluorobenzamide;4-(6-methoxy-7-methylquinazolin-4-yl)-N-(4-propan-2-yloxyphenyl)piperazine-1-carboxamide;4-(7-methoxy-6-methylquinazolin-4-yl)-N-(4-propan-2-yloxyphenyl)piperazine-1-carboxamide?
The InChIKey is AXUFQQUXWHPQFV-WAAXXEHPSA-N. The full InChI is InChI=1S/C30H45N7O4.2C24H29N5O3.C18H16ClF2IN2O2.C18H17ClF2N2O2/c1-22(2)41-24-8-6-23(7-9-24)33-30(38)37-17-15-36(16-18-37)29(32)25-20-27(39-4)28(21-26(25)31)40-19-5-10-35-13-11-34(3)12-14-35;1-16(2)32-19-7-5-18(6-8-19)27-24(30)29-11-9-28(10-12-29)23-20-14-22(31-4)17(3)13-21(20)25-15-26-23;1-16(2)32-19-7-5-18(6-8-19)27-24(30)29-11-9-28(10-12-29)23-20-13-17(3)22(31-4)14-21(20)25-15-26-23;1-9-6-15(12(19)7-14(9)22)23-17-11(4-5-13(20)16(17)21)18(25)24-26-8-10-2-3-10;1-10-2-7-15(13(19)8-10)22-17-12(5-6-14(20)16(17)21)18(24)23-25-9-11-3-4-11/h6-9,20-22,32H,5,10-19,31H2,1-4H3,(H,33,38);2*5-8,13-16H,9-12H2,1-4H3,(H,27,30);4-7,10,23H,2-3,8H2,1H3,(H,24,25);2,5-8,11,22H,3-4,9H2,1H3,(H,23,24)/b32-29-;;;;.
What are the key properties of 4-[2-amino-5-methoxy-4-[3-(4-methylpiperazin-1-yl)propoxy]benzenecarboximidoyl]-N-(4-propan-2-yloxyphenyl)piperazine-1-carboxamide;2-(2-chloro-4-iodo-5-methylanilino)-N-(cyclopropylmethoxy)-3,4-difluorobenzamide;2-(2-chloro-4-methylanilino)-N-(cyclopropylmethoxy)-3,4-difluorobenzamide;4-(6-methoxy-7-methylquinazolin-4-yl)-N-(4-propan-2-yloxyphenyl)piperazine-1-carboxamide;4-(7-methoxy-6-methylquinazolin-4-yl)-N-(4-propan-2-yloxyphenyl)piperazine-1-carboxamide?
4-[2-amino-5-methoxy-4-[3-(4-methylpiperazin-1-yl)propoxy]benzenecarboximidoyl]-N-(4-propan-2-yloxyphenyl)piperazine-1-carboxamide;2-(2-chloro-4-iodo-5-methylanilino)-N-(cyclopropylmethoxy)-3,4-difluorobenzamide;2-(2-chloro-4-methylanilino)-N-(cyclopropylmethoxy)-3,4-difluorobenzamide;4-(6-methoxy-7-methylquinazolin-4-yl)-N-(4-propan-2-yloxyphenyl)piperazine-1-carboxamide;4-(7-methoxy-6-methylquinazolin-4-yl)-N-(4-propan-2-yloxyphenyl)piperazine-1-carboxamide has a molecular weight of 2298.28 g/mol, XLogP of 21.52, 32 rotatable bonds, 9 hydrogen bond donors, and 26 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[2-amino-5-methoxy-4-[3-(4-methylpiperazin-1-yl)propoxy]benzenecarboximidoyl]-N-(4-propan-2-yloxyphenyl)piperazine-1-carboxamide;2-(2-chloro-4-iodo-5-methylanilino)-N-(cyclopropylmethoxy)-3,4-difluorobenzamide;2-(2-chloro-4-methylanilino)-N-(cyclopropylmethoxy)-3,4-difluorobenzamide;4-(6-methoxy-7-methylquinazolin-4-yl)-N-(4-propan-2-yloxyphenyl)piperazine-1-carboxamide;4-(7-methoxy-6-methylquinazolin-4-yl)-N-(4-propan-2-yloxyphenyl)piperazine-1-carboxamide is sourced from PubChem (CID 157264028), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).