4-[5-(3-methylphenoxy)carbonyl-1,3-dioxoisoindol-2-yl]butane-2-sulfonic acid;(4-methylphenyl) 4-[bis[3-(dimethylamino)propyl]carbamoyl]benzoate;(3-methylphenyl) 2-[3-(diethylamino)propyl]-1,3-dioxoisoindole-5-carboxylate;(4-methylphenyl) 2-[2-(dimethylamino)ethyl]-1,3-dioxoisoindole-5-carboxylate;(4-methylphenyl) 2-[2-(4-methylpiperazin-1-yl)ethyl]-1,3-dioxoisoindole-5-carboxylate

C111H125N11O22S — CID 161065952

IUPAC4-[5-(3-methylphenoxy)carbonyl-1,3-dioxoisoindol-2-yl]butane-2-sulfonic acid;(4-methylphenyl) 4-[bis[3-(dimethylamino)propyl]carbamoyl]benzoate;(3-methylphenyl) 2-[3-(diethylamino)propyl]-1,3-dioxoisoindole-5-carboxylate;(4-methylphenyl) 2-[2-(dimethylamino)ethyl]-1,3-dioxoisoindole-5-carboxylate;(4-methylphenyl) 2-[2-(4-methylpiperazin-1-yl)ethyl]-1,3-dioxoisoindole-5-carboxylate
SMILESCCN(CC)CCCN1C(=O)c2ccc(C(=O)Oc3cccc(C)c3)cc2C1=O.Cc1ccc(OC(=O)c2ccc(C(=O)N(CCCN(C)C)CCCN(C)C)cc2)cc1.Cc1ccc(OC(=O)c2ccc3c(c2)C(=O)N(CCN(C)C)C3=O)cc1.Cc1ccc(OC(=O)c2ccc3c(c2)C(=O)N(CCN2CCN(C)CC2)C3=O)cc1.Cc1cccc(OC(=O)c2ccc3c(c2)C(=O)N(CCC(C)S(=O)(=O)O)C3=O)c1
InChIInChI=1S/C25H35N3O3.C23H25N3O4.C23H26N2O4.C20H20N2O4.C20H19NO7S/c1-20-8-14-23(15-9-20)31-25(30)22-12-10-21(11-13-22)24(29)28(18-6-16-26(2)3)19-7-17-27(4)5;1-16-3-6-18(7-4-16)30-23(29)17-5-8-19-20(15-17)22(28)26(21(19)27)14-13-25-11-9-24(2)10-12-25;1-4-24(5-2)12-7-13-25-21(26)19-11-10-17(15-20(19)22(25)27)23(28)29-18-9-6-8-16(3)14-18;1-13-4-7-15(8-5-13)26-20(25)14-6-9-16-17(12-14)19(24)22(18(16)23)11-10-21(2)3;1-12-4-3-5-15(10-12)28-20(24)14-6-7-16-17(11-14)19(23)21(18(16)22)9-8-13(2)29(25,26)27/h8-15H,6-7,16-19H2,1-5H3;3-8,15H,9-14H2,1-2H3;6,8-11,14-15H,4-5,7,12-13H2,1-3H3;4-9,12H,10-11H2,1-3H3;3-7,10-11,13H,8-9H2,1-2H3,(H,25,26,27)
InChIKeyUEAGWCHCTJHSOR-UHFFFAOYSA-N
MW1997.34 g/mol
LogP14.01
Rot. Bonds35

About 4-[5-(3-methylphenoxy)carbonyl-1,3-dioxoisoindol-2-yl]butane-2-sulfonic acid;(4-methylphenyl) 4-[bis[3-(dimethylamino)propyl]carbamoyl]benzoate;(3-methylphenyl) 2-[3-(diethylamino)propyl]-1,3-dioxoisoindole-5-carboxylate;(4-methylphenyl) 2-[2-(dimethylamino)ethyl]-1,3-dioxoisoindole-5-carboxylate;(4-methylphenyl) 2-[2-(4-methylpiperazin-1-yl)ethyl]-1,3-dioxoisoindole-5-carboxylate

4-[5-(3-methylphenoxy)carbonyl-1,3-dioxoisoindol-2-yl]butane-2-sulfonic acid;(4-methylphenyl) 4-[bis[3-(dimethylamino)propyl]carbamoyl]benzoate;(3-methylphenyl) 2-[3-(diethylamino)propyl]-1,3-dioxoisoindole-5-carboxylate;(4-methylphenyl) 2-[2-(dimethylamino)ethyl]-1,3-dioxoisoindole-5-carboxylate;(4-methylphenyl) 2-[2-(4-methylpiperazin-1-yl)ethyl]-1,3-dioxoisoindole-5-carboxylate (PubChem CID 161065952) has the molecular formula C111H125N11O22S and a molecular weight of 1997.34 g/mol. Its IUPAC name is 4-[5-(3-methylphenoxy)carbonyl-1,3-dioxoisoindol-2-yl]butane-2-sulfonic acid;(4-methylphenyl) 4-[bis[3-(dimethylamino)propyl]carbamoyl]benzoate;(3-methylphenyl) 2-[3-(diethylamino)propyl]-1,3-dioxoisoindole-5-carboxylate;(4-methylphenyl) 2-[2-(dimethylamino)ethyl]-1,3-dioxoisoindole-5-carboxylate;(4-methylphenyl) 2-[2-(4-methylpiperazin-1-yl)ethyl]-1,3-dioxoisoindole-5-carboxylate.

Molecular Properties

Compound Name4-[5-(3-methylphenoxy)carbonyl-1,3-dioxoisoindol-2-yl]butane-2-sulfonic acid;(4-methylphenyl) 4-[bis[3-(dimethylamino)propyl]carbamoyl]benzoate;(3-methylphenyl) 2-[3-(diethylamino)propyl]-1,3-dioxoisoindole-5-carboxylate;(4-methylphenyl) 2-[2-(dimethylamino)ethyl]-1,3-dioxoisoindole-5-carboxylate;(4-methylphenyl) 2-[2-(4-methylpiperazin-1-yl)ethyl]-1,3-dioxoisoindole-5-carboxylate
PubChem CID161065952
Molecular FormulaC111H125N11O22S
Molecular Weight1997.34 g/mol
Exact Mass1995.87
IUPAC Name4-[5-(3-methylphenoxy)carbonyl-1,3-dioxoisoindol-2-yl]butane-2-sulfonic acid;(4-methylphenyl) 4-[bis[3-(dimethylamino)propyl]carbamoyl]benzoate;(3-methylphenyl) 2-[3-(diethylamino)propyl]-1,3-dioxoisoindole-5-carboxylate;(4-methylphenyl) 2-[2-(dimethylamino)ethyl]-1,3-dioxoisoindole-5-carboxylate;(4-methylphenyl) 2-[2-(4-methylpiperazin-1-yl)ethyl]-1,3-dioxoisoindole-5-carboxylate
SMILESCCN(CC)CCCN1C(=O)c2ccc(C(=O)Oc3cccc(C)c3)cc2C1=O.Cc1ccc(OC(=O)c2ccc(C(=O)N(CCCN(C)C)CCCN(C)C)cc2)cc1.Cc1ccc(OC(=O)c2ccc3c(c2)C(=O)N(CCN(C)C)C3=O)cc1.Cc1ccc(OC(=O)c2ccc3c(c2)C(=O)N(CCN2CCN(C)CC2)C3=O)cc1.Cc1cccc(OC(=O)c2ccc3c(c2)C(=O)N(CCC(C)S(=O)(=O)O)C3=O)c1
InChIInChI=1S/C25H35N3O3.C23H25N3O4.C23H26N2O4.C20H20N2O4.C20H19NO7S/c1-20-8-14-23(15-9-20)31-25(30)22-12-10-21(11-13-22)24(29)28(18-6-16-26(2)3)19-7-17-27(4)5;1-16-3-6-18(7-4-16)30-23(29)17-5-8-19-20(15-17)22(28)26(21(19)27)14-13-25-11-9-24(2)10-12-25;1-4-24(5-2)12-7-13-25-21(26)19-11-10-17(15-20(19)22(25)27)23(28)29-18-9-6-8-16(3)14-18;1-13-4-7-15(8-5-13)26-20(25)14-6-9-16-17(12-14)19(24)22(18(16)23)11-10-21(2)3;1-12-4-3-5-15(10-12)28-20(24)14-6-7-16-17(11-14)19(23)21(18(16)22)9-8-13(2)29(25,26)27/h8-15H,6-7,16-19H2,1-5H3;3-8,15H,9-14H2,1-2H3;6,8-11,14-15H,4-5,7,12-13H2,1-3H3;4-9,12H,10-11H2,1-3H3;3-7,10-11,13H,8-9H2,1-2H3,(H,25,26,27)
InChIKeyUEAGWCHCTJHSOR-UHFFFAOYSA-N
XLogP14.01
TPSA375.14 Ų
H-Bond Donors1
H-Bond Acceptors27
Rotatable Bonds35
Heavy Atoms145
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5001997.34
LogP ≤ 514.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 1027

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'phenol_ester', 'substructure': 'N/A'}, {'alert_name': 'phthalimide', 'substructure': 'N/A'}, {'alert_name': 'Sulfonic_acid_2', 'substructure': 'N/A'}

Analyze 4-[5-(3-methylphenoxy)carbonyl-1,3-dioxoisoindol-2-yl]butane-2-sulfonic acid;(4-methylphenyl) 4-[bis[3-(dimethylamino)propyl]carbamoyl]benzoate;(3-methylphenyl) 2-[3-(diethylamino)propyl]-1,3-dioxoisoindole-5-carboxylate;(4-methylphenyl) 2-[2-(dimethylamino)ethyl]-1,3-dioxoisoindole-5-carboxylate;(4-methylphenyl) 2-[2-(4-methylpiperazin-1-yl)ethyl]-1,3-dioxoisoindole-5-carboxylate 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-[4-[4-[2-[10-(2,5-Dioxopyrrol-1-yl)decyl]-1,3-dioxoisoindole-5-carbonyl]oxybenzoyl]oxy-3-methylphenoxy]carbonylphenyl] 2-[10-(2,5-dioxopyrrol-1-yl)decyl]-1,3-dioxoisoindole-5-carboxylate
CID 156627217
[4-[4-[2-[6-(2,5-Dioxopyrrol-1-yl)hexyl]-1,3-dioxoisoindole-5-carbonyl]oxyphenyl]phenyl] 2-[6-(2,5-dioxopyrrol-1-yl)hexyl]-1,3-dioxoisoindole-5-carboxylate
CID 156627219
[4-[4-[4-[2-[6-(2,5-Dioxopyrrol-1-yl)hexyl]-1,3-dioxoisoindole-5-carbonyl]oxybenzoyl]oxy-3-methylphenoxy]carbonylphenyl] 2-[6-(2,5-dioxopyrrol-1-yl)hexyl]-1,3-dioxoisoindole-5-carboxylate
CID 156627220
5-[2-[4-(Tert-butylsulfonylmethyl)cyclohexyl]-2-oxoethyl]-2-(2-methylpropyl)isoindole-1,3-dione;7-(7-tert-butylsulfonyl-2-oxoheptyl)-4-methylchromen-2-one;5-(7-tert-butylsulfonyl-2-oxoheptyl)-2-(2-methylpropyl)isoindole-1,3-dione;4-methyl-7-(2-oxo-7-propan-2-ylsulfonylheptyl)chromen-2-one;4-methyl-7-[2-oxo-2-[4-(propan-2-ylsulfonylmethyl)cyclohexyl]ethyl]chromen-2-one;2-(2-methylpropyl)-5-(2-oxo-7-propan-2-ylsulfonylheptyl)isoindole-1,3-dione;2-(2-methylpropyl)-5-[2-oxo-2-[4-(propan-2-ylsulfonylmethyl)cyclohexyl]ethyl]isoindole-1,3-dione
CID 157188721
2,6-Bis[8-[2-[8-(2,5-dioxopyrrol-1-yl)octyl]-4-hexyl-3-octylcyclohexyl]octyl]pyrrolo[3,4-f]isoindole-1,3,5,7-tetrone;2-[8-[2-[8-(2,5-dioxopyrrol-1-yl)octyl]-4-hexyl-3-octylcyclohexyl]octyl]-5-[2-[8-[2-[8-(2,5-dioxopyrrol-1-yl)octyl]-4-hexyl-3-octylcyclohexyl]octyl]-1,3-dioxoisoindol-5-yl]oxyisoindole-1,3-dione
CID 157899058
[4-(2-Methyl-1,3-dioxoisoindole-5-carbonyl)oxyphenyl] 2-methyl-1,3-dioxoisoindole-5-carboxylate;[4-[4-(2-methyl-1,3-dioxoisoindole-5-carbonyl)oxyphenyl]phenyl] 2-methyl-1,3-dioxoisoindole-5-carboxylate
CID 159306925
Bis([4-[2-[(3,4-dimethyl-2,5-dioxopyrrol-1-yl)methyl]-1,3-dioxoisoindole-5-carbonyl]oxy-3-methylphenyl] 2-[(3,4-dimethyl-2,5-dioxopyrrol-1-yl)methyl]-1,3-dioxoisoindole-5-carboxylate);[4-[4-[2-[(3,4-dimethyl-2,5-dioxopyrrol-1-yl)methyl]-1,3-dioxoisoindole-5-carbonyl]oxyphenyl]phenyl] 2-[(3,4-dimethyl-2,5-dioxopyrrol-1-yl)methyl]-1,3-dioxoisoindole-5-carboxylate;bis([4-[2-[(2,5-dioxopyrrol-1-yl)methyl]-1,3-dioxoisoindole-5-carbonyl]oxy-3-methylphenyl] 2-[(2,5-dioxopyrrol-1-yl)methyl]-1,3-dioxoisoindole-5-carboxylate);[4-[4-[2-[(2,5-dioxopyrrol-1-yl)methyl]-1,3-dioxoisoindole-5-carbonyl]oxyphenyl]phenyl] 2-[(2,5-dioxopyrrol-1-yl)methyl]-1,3-dioxoisoindole-5-carboxylate
CID 160461904
4-[5-(3-Methylphenoxy)carbonyl-1,3-dioxoisoindol-2-yl]butane-1-sulfonic acid;4-[5-(4-methylphenoxy)carbonyl-1,3-dioxoisoindol-2-yl]butane-1-sulfonic acid;4-[5-(4-methylphenoxy)carbonyl-1,3-dioxoisoindol-2-yl]butane-2-sulfonic acid;3-[5-(3-methylphenoxy)carbonyl-1,3-dioxoisoindol-2-yl]propane-1-sulfonic acid;3-[5-(4-methylphenoxy)carbonyl-1,3-dioxoisoindol-2-yl]propane-1-sulfonic acid;(4-methylphenyl) 2-[3-(diethylamino)propyl]-1,3-dioxoisoindole-5-carboxylate
CID 160842735
Bis([4-[3-[4-[2-[(3,4-dimethyl-2,5-dioxopyrrol-1-yl)methyl]-1,3-dioxoisoindole-5-carbonyl]oxyphenyl]-1-adamantyl]phenyl] 2-[(3,4-dimethyl-2,5-dioxopyrrol-1-yl)methyl]-1,3-dioxoisoindole-5-carboxylate);[4-[3-[4-[2-[(2,5-dioxopyrrol-1-yl)methyl]-1,3-dioxoisoindole-5-carbonyl]oxyphenyl]-1-adamantyl]phenyl] 2-[(2,5-dioxopyrrol-1-yl)methyl]-1,3-dioxoisoindole-5-carboxylate
CID 161036777
Ethane;[4-(4-ethylbenzoyl)oxyphenyl] 4-ethylbenzoate;[4-[4-(4-ethylbenzoyl)oxyphenyl]phenyl] 4-ethylbenzoate;[4-[4-[4-(2-ethyl-1,3-dioxoisoindole-5-carbonyl)oxybenzoyl]oxyphenoxy]carbonylphenyl] 2-ethyl-1,3-dioxoisoindole-5-carboxylate;[4-(2-ethyl-1,3-dioxoisoindole-5-carbonyl)oxyphenyl] 2-ethyl-1,3-dioxoisoindole-5-carboxylate;[4-[4-(2-ethyl-1,3-dioxoisoindole-5-carbonyl)oxyphenyl]phenyl] 2-ethyl-1,3-dioxoisoindole-5-carboxylate;[4-(4-ethylphenoxy)carbonylphenyl] 4-ethylbenzoate
CID 163567346
Bis([4-[2-[(3,4-dimethyl-2,5-dioxopyrrol-1-yl)methyl]-1,3-dioxoisoindole-5-carbonyl]oxy-3-methylphenyl] 2-[(3,4-dimethyl-2,5-dioxopyrrol-1-yl)methyl]-1,3-dioxoisoindole-5-carboxylate);bis([4-[4-[2-[(3,4-dimethyl-2,5-dioxopyrrol-1-yl)methyl]-1,3-dioxoisoindole-5-carbonyl]oxyphenyl]phenyl] 2-[(3,4-dimethyl-2,5-dioxopyrrol-1-yl)methyl]-1,3-dioxoisoindole-5-carboxylate);[4-[4-[2-[(3-methyl-2,5-dioxopyrrol-1-yl)methyl]-1,3-dioxoisoindole-5-carbonyl]oxyphenyl]phenyl] 2-[(3-methyl-2,5-dioxopyrrol-1-yl)methyl]-1,3-dioxoisoindole-5-carboxylate;bis([3-methyl-4-[2-[(3-methyl-2,5-dioxopyrrol-1-yl)methyl]-1,3-dioxoisoindole-5-carbonyl]oxyphenyl] 2-[(3-methyl-2,5-dioxopyrrol-1-yl)methyl]-1,3-dioxoisoindole-5-carboxylate)
CID 164143943
Ethane;[4-(4-ethylbenzoyl)oxyphenyl] 4-ethylbenzoate;[4-[4-(4-ethylbenzoyl)oxyphenyl]phenyl] 4-ethylbenzoate;[4-[4-[4-(2-ethyl-1,3-dioxoisoindole-5-carbonyl)oxybenzoyl]oxyphenoxy]carbonylphenyl] 2-ethyl-1,3-dioxoisoindole-5-carboxylate;[4-(2-ethyl-1,3-dioxoisoindole-5-carbonyl)oxyphenyl] 2-ethyl-1,3-dioxoisoindole-5-carboxylate;[4-[4-(2-ethyl-1,3-dioxoisoindole-5-carbonyl)oxyphenyl]phenyl] 2-ethyl-1,3-dioxoisoindole-5-carboxylate;[4-(4-ethylphenoxy)carbonylphenyl] 4-ethylbenzoate;methane
CID 164172005

Frequently Asked Questions

What is the IUPAC name of 4-[5-(3-methylphenoxy)carbonyl-1,3-dioxoisoindol-2-yl]butane-2-sulfonic acid;(4-methylphenyl) 4-[bis[3-(dimethylamino)propyl]carbamoyl]benzoate;(3-methylphenyl) 2-[3-(diethylamino)propyl]-1,3-dioxoisoindole-5-carboxylate;(4-methylphenyl) 2-[2-(dimethylamino)ethyl]-1,3-dioxoisoindole-5-carboxylate;(4-methylphenyl) 2-[2-(4-methylpiperazin-1-yl)ethyl]-1,3-dioxoisoindole-5-carboxylate?
The IUPAC name of 4-[5-(3-methylphenoxy)carbonyl-1,3-dioxoisoindol-2-yl]butane-2-sulfonic acid;(4-methylphenyl) 4-[bis[3-(dimethylamino)propyl]carbamoyl]benzoate;(3-methylphenyl) 2-[3-(diethylamino)propyl]-1,3-dioxoisoindole-5-carboxylate;(4-methylphenyl) 2-[2-(dimethylamino)ethyl]-1,3-dioxoisoindole-5-carboxylate;(4-methylphenyl) 2-[2-(4-methylpiperazin-1-yl)ethyl]-1,3-dioxoisoindole-5-carboxylate (CID 161065952) is 4-[5-(3-methylphenoxy)carbonyl-1,3-dioxoisoindol-2-yl]butane-2-sulfonic acid;(4-methylphenyl) 4-[bis[3-(dimethylamino)propyl]carbamoyl]benzoate;(3-methylphenyl) 2-[3-(diethylamino)propyl]-1,3-dioxoisoindole-5-carboxylate;(4-methylphenyl) 2-[2-(dimethylamino)ethyl]-1,3-dioxoisoindole-5-carboxylate;(4-methylphenyl) 2-[2-(4-methylpiperazin-1-yl)ethyl]-1,3-dioxoisoindole-5-carboxylate.
What is the SMILES notation for 4-[5-(3-methylphenoxy)carbonyl-1,3-dioxoisoindol-2-yl]butane-2-sulfonic acid;(4-methylphenyl) 4-[bis[3-(dimethylamino)propyl]carbamoyl]benzoate;(3-methylphenyl) 2-[3-(diethylamino)propyl]-1,3-dioxoisoindole-5-carboxylate;(4-methylphenyl) 2-[2-(dimethylamino)ethyl]-1,3-dioxoisoindole-5-carboxylate;(4-methylphenyl) 2-[2-(4-methylpiperazin-1-yl)ethyl]-1,3-dioxoisoindole-5-carboxylate?
The canonical SMILES for 4-[5-(3-methylphenoxy)carbonyl-1,3-dioxoisoindol-2-yl]butane-2-sulfonic acid;(4-methylphenyl) 4-[bis[3-(dimethylamino)propyl]carbamoyl]benzoate;(3-methylphenyl) 2-[3-(diethylamino)propyl]-1,3-dioxoisoindole-5-carboxylate;(4-methylphenyl) 2-[2-(dimethylamino)ethyl]-1,3-dioxoisoindole-5-carboxylate;(4-methylphenyl) 2-[2-(4-methylpiperazin-1-yl)ethyl]-1,3-dioxoisoindole-5-carboxylate is CCN(CC)CCCN1C(=O)c2ccc(C(=O)Oc3cccc(C)c3)cc2C1=O.Cc1ccc(OC(=O)c2ccc(C(=O)N(CCCN(C)C)CCCN(C)C)cc2)cc1.Cc1ccc(OC(=O)c2ccc3c(c2)C(=O)N(CCN(C)C)C3=O)cc1.Cc1ccc(OC(=O)c2ccc3c(c2)C(=O)N(CCN2CCN(C)CC2)C3=O)cc1.Cc1cccc(OC(=O)c2ccc3c(c2)C(=O)N(CCC(C)S(=O)(=O)O)C3=O)c1.
What is the InChIKey of 4-[5-(3-methylphenoxy)carbonyl-1,3-dioxoisoindol-2-yl]butane-2-sulfonic acid;(4-methylphenyl) 4-[bis[3-(dimethylamino)propyl]carbamoyl]benzoate;(3-methylphenyl) 2-[3-(diethylamino)propyl]-1,3-dioxoisoindole-5-carboxylate;(4-methylphenyl) 2-[2-(dimethylamino)ethyl]-1,3-dioxoisoindole-5-carboxylate;(4-methylphenyl) 2-[2-(4-methylpiperazin-1-yl)ethyl]-1,3-dioxoisoindole-5-carboxylate?
The InChIKey is UEAGWCHCTJHSOR-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H35N3O3.C23H25N3O4.C23H26N2O4.C20H20N2O4.C20H19NO7S/c1-20-8-14-23(15-9-20)31-25(30)22-12-10-21(11-13-22)24(29)28(18-6-16-26(2)3)19-7-17-27(4)5;1-16-3-6-18(7-4-16)30-23(29)17-5-8-19-20(15-17)22(28)26(21(19)27)14-13-25-11-9-24(2)10-12-25;1-4-24(5-2)12-7-13-25-21(26)19-11-10-17(15-20(19)22(25)27)23(28)29-18-9-6-8-16(3)14-18;1-13-4-7-15(8-5-13)26-20(25)14-6-9-16-17(12-14)19(24)22(18(16)23)11-10-21(2)3;1-12-4-3-5-15(10-12)28-20(24)14-6-7-16-17(11-14)19(23)21(18(16)22)9-8-13(2)29(25,26)27/h8-15H,6-7,16-19H2,1-5H3;3-8,15H,9-14H2,1-2H3;6,8-11,14-15H,4-5,7,12-13H2,1-3H3;4-9,12H,10-11H2,1-3H3;3-7,10-11,13H,8-9H2,1-2H3,(H,25,26,27).
What are the key properties of 4-[5-(3-methylphenoxy)carbonyl-1,3-dioxoisoindol-2-yl]butane-2-sulfonic acid;(4-methylphenyl) 4-[bis[3-(dimethylamino)propyl]carbamoyl]benzoate;(3-methylphenyl) 2-[3-(diethylamino)propyl]-1,3-dioxoisoindole-5-carboxylate;(4-methylphenyl) 2-[2-(dimethylamino)ethyl]-1,3-dioxoisoindole-5-carboxylate;(4-methylphenyl) 2-[2-(4-methylpiperazin-1-yl)ethyl]-1,3-dioxoisoindole-5-carboxylate?
4-[5-(3-methylphenoxy)carbonyl-1,3-dioxoisoindol-2-yl]butane-2-sulfonic acid;(4-methylphenyl) 4-[bis[3-(dimethylamino)propyl]carbamoyl]benzoate;(3-methylphenyl) 2-[3-(diethylamino)propyl]-1,3-dioxoisoindole-5-carboxylate;(4-methylphenyl) 2-[2-(dimethylamino)ethyl]-1,3-dioxoisoindole-5-carboxylate;(4-methylphenyl) 2-[2-(4-methylpiperazin-1-yl)ethyl]-1,3-dioxoisoindole-5-carboxylate has a molecular weight of 1997.34 g/mol, XLogP of 14.01, 35 rotatable bonds, 1 hydrogen bond donors, and 27 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[5-(3-methylphenoxy)carbonyl-1,3-dioxoisoindol-2-yl]butane-2-sulfonic acid;(4-methylphenyl) 4-[bis[3-(dimethylamino)propyl]carbamoyl]benzoate;(3-methylphenyl) 2-[3-(diethylamino)propyl]-1,3-dioxoisoindole-5-carboxylate;(4-methylphenyl) 2-[2-(dimethylamino)ethyl]-1,3-dioxoisoindole-5-carboxylate;(4-methylphenyl) 2-[2-(4-methylpiperazin-1-yl)ethyl]-1,3-dioxoisoindole-5-carboxylate is sourced from PubChem (CID 161065952), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).