2-(1,1-difluoroethyl)-3H-benzo[e]benzimidazole-4,5-dione;2-[(4-fluorophenoxy)methyl]-3H-benzo[e]benzimidazole-4,5-dione;2-[(4-fluorophenoxy)methyl]-3-methylbenzo[e]benzimidazole-4,5-dione;2-propan-2-yl-3-(pyridin-2-ylmethyl)benzo[e]benzimidazole-4,5-dione;2-propan-2-yl-3-(pyridin-3-ylmethyl)benzo[e]benzimidazole-4,5-dione;2-propan-2-yl-3-(pyridin-4-ylmethyl)benzo[e]benzimidazole-4,5-dione

C110H83F4N15O14 — CID 161373924

IUPAC2-(1,1-difluoroethyl)-3H-benzo[e]benzimidazole-4,5-dione;2-[(4-fluorophenoxy)methyl]-3H-benzo[e]benzimidazole-4,5-dione;2-[(4-fluorophenoxy)methyl]-3-methylbenzo[e]benzimidazole-4,5-dione;2-propan-2-yl-3-(pyridin-2-ylmethyl)benzo[e]benzimidazole-4,5-dione;2-propan-2-yl-3-(pyridin-3-ylmethyl)benzo[e]benzimidazole-4,5-dione;2-propan-2-yl-3-(pyridin-4-ylmethyl)benzo[e]benzimidazole-4,5-dione
SMILESCC(C)c1nc2c(n1Cc1ccccn1)C(=O)C(=O)c1ccccc1-2.CC(C)c1nc2c(n1Cc1cccnc1)C(=O)C(=O)c1ccccc1-2.CC(C)c1nc2c(n1Cc1ccncc1)C(=O)C(=O)c1ccccc1-2.CC(F)(F)c1nc2c([nH]1)C(=O)C(=O)c1ccccc1-2.Cn1c(COc2ccc(F)cc2)nc2c1C(=O)C(=O)c1ccccc1-2.O=C1C(=O)c2[nH]c(COc3ccc(F)cc3)nc2-c2ccccc21
InChIInChI=1S/3C20H17N3O2.C19H13FN2O3.C18H11FN2O3.C13H8F2N2O2/c1-12(2)20-22-16-14-8-3-4-9-15(14)18(24)19(25)17(16)23(20)11-13-7-5-6-10-21-13;1-12(2)20-22-16-14-7-3-4-8-15(14)18(24)19(25)17(16)23(20)11-13-6-5-9-21-10-13;1-12(2)20-22-16-14-5-3-4-6-15(14)18(24)19(25)17(16)23(20)11-13-7-9-21-10-8-13;1-22-15(10-25-12-8-6-11(20)7-9-12)21-16-13-4-2-3-5-14(13)18(23)19(24)17(16)22;19-10-5-7-11(8-6-10)24-9-14-20-15-12-3-1-2-4-13(12)17(22)18(23)16(15)21-14;1-13(14,15)12-16-8-6-4-2-3-5-7(6)10(18)11(19)9(8)17-12/h3*3-10,12H,11H2,1-2H3;2-9H,10H2,1H3;1-8H,9H2,(H,20,21);2-5H,1H3,(H,16,17)
InChIKeyVQVGHKWCWSQTES-UHFFFAOYSA-N
MW1914.96 g/mol
LogP19.41
Rot. Bonds16

About 2-(1,1-difluoroethyl)-3H-benzo[e]benzimidazole-4,5-dione;2-[(4-fluorophenoxy)methyl]-3H-benzo[e]benzimidazole-4,5-dione;2-[(4-fluorophenoxy)methyl]-3-methylbenzo[e]benzimidazole-4,5-dione;2-propan-2-yl-3-(pyridin-2-ylmethyl)benzo[e]benzimidazole-4,5-dione;2-propan-2-yl-3-(pyridin-3-ylmethyl)benzo[e]benzimidazole-4,5-dione;2-propan-2-yl-3-(pyridin-4-ylmethyl)benzo[e]benzimidazole-4,5-dione

2-(1,1-difluoroethyl)-3H-benzo[e]benzimidazole-4,5-dione;2-[(4-fluorophenoxy)methyl]-3H-benzo[e]benzimidazole-4,5-dione;2-[(4-fluorophenoxy)methyl]-3-methylbenzo[e]benzimidazole-4,5-dione;2-propan-2-yl-3-(pyridin-2-ylmethyl)benzo[e]benzimidazole-4,5-dione;2-propan-2-yl-3-(pyridin-3-ylmethyl)benzo[e]benzimidazole-4,5-dione;2-propan-2-yl-3-(pyridin-4-ylmethyl)benzo[e]benzimidazole-4,5-dione (PubChem CID 161373924) has the molecular formula C110H83F4N15O14 and a molecular weight of 1914.96 g/mol. Its IUPAC name is 2-(1,1-difluoroethyl)-3H-benzo[e]benzimidazole-4,5-dione;2-[(4-fluorophenoxy)methyl]-3H-benzo[e]benzimidazole-4,5-dione;2-[(4-fluorophenoxy)methyl]-3-methylbenzo[e]benzimidazole-4,5-dione;2-propan-2-yl-3-(pyridin-2-ylmethyl)benzo[e]benzimidazole-4,5-dione;2-propan-2-yl-3-(pyridin-3-ylmethyl)benzo[e]benzimidazole-4,5-dione;2-propan-2-yl-3-(pyridin-4-ylmethyl)benzo[e]benzimidazole-4,5-dione.

Molecular Properties

Compound Name2-(1,1-difluoroethyl)-3H-benzo[e]benzimidazole-4,5-dione;2-[(4-fluorophenoxy)methyl]-3H-benzo[e]benzimidazole-4,5-dione;2-[(4-fluorophenoxy)methyl]-3-methylbenzo[e]benzimidazole-4,5-dione;2-propan-2-yl-3-(pyridin-2-ylmethyl)benzo[e]benzimidazole-4,5-dione;2-propan-2-yl-3-(pyridin-3-ylmethyl)benzo[e]benzimidazole-4,5-dione;2-propan-2-yl-3-(pyridin-4-ylmethyl)benzo[e]benzimidazole-4,5-dione
PubChem CID161373924
Molecular FormulaC110H83F4N15O14
Molecular Weight1914.96 g/mol
Exact Mass1913.62
IUPAC Name2-(1,1-difluoroethyl)-3H-benzo[e]benzimidazole-4,5-dione;2-[(4-fluorophenoxy)methyl]-3H-benzo[e]benzimidazole-4,5-dione;2-[(4-fluorophenoxy)methyl]-3-methylbenzo[e]benzimidazole-4,5-dione;2-propan-2-yl-3-(pyridin-2-ylmethyl)benzo[e]benzimidazole-4,5-dione;2-propan-2-yl-3-(pyridin-3-ylmethyl)benzo[e]benzimidazole-4,5-dione;2-propan-2-yl-3-(pyridin-4-ylmethyl)benzo[e]benzimidazole-4,5-dione
SMILESCC(C)c1nc2c(n1Cc1ccccn1)C(=O)C(=O)c1ccccc1-2.CC(C)c1nc2c(n1Cc1cccnc1)C(=O)C(=O)c1ccccc1-2.CC(C)c1nc2c(n1Cc1ccncc1)C(=O)C(=O)c1ccccc1-2.CC(F)(F)c1nc2c([nH]1)C(=O)C(=O)c1ccccc1-2.Cn1c(COc2ccc(F)cc2)nc2c1C(=O)C(=O)c1ccccc1-2.O=C1C(=O)c2[nH]c(COc3ccc(F)cc3)nc2-c2ccccc21
InChIInChI=1S/3C20H17N3O2.C19H13FN2O3.C18H11FN2O3.C13H8F2N2O2/c1-12(2)20-22-16-14-8-3-4-9-15(14)18(24)19(25)17(16)23(20)11-13-7-5-6-10-21-13;1-12(2)20-22-16-14-7-3-4-8-15(14)18(24)19(25)17(16)23(20)11-13-6-5-9-21-10-13;1-12(2)20-22-16-14-5-3-4-6-15(14)18(24)19(25)17(16)23(20)11-13-7-9-21-10-8-13;1-22-15(10-25-12-8-6-11(20)7-9-12)21-16-13-4-2-3-5-14(13)18(23)19(24)17(16)22;19-10-5-7-11(8-6-10)24-9-14-20-15-12-3-1-2-4-13(12)17(22)18(23)16(15)21-14;1-13(14,15)12-16-8-6-4-2-3-5-7(6)10(18)11(19)9(8)17-12/h3*3-10,12H,11H2,1-2H3;2-9H,10H2,1H3;1-8H,9H2,(H,20,21);2-5H,1H3,(H,16,17)
InChIKeyVQVGHKWCWSQTES-UHFFFAOYSA-N
XLogP19.41
TPSA390.61 Ų
H-Bond Donors2
H-Bond Acceptors27
Rotatable Bonds16
Heavy Atoms143
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5001914.96
LogP ≤ 519.41
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 1027

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_one_A(321)', 'substructure': 'N/A'}, {'alert_name': 'quinone_D(2)', 'substructure': 'N/A'}, {'alert_name': 'diketo_group', 'substructure': 'N/A'}

Analyze 2-(1,1-difluoroethyl)-3H-benzo[e]benzimidazole-4,5-dione;2-[(4-fluorophenoxy)methyl]-3H-benzo[e]benzimidazole-4,5-dione;2-[(4-fluorophenoxy)methyl]-3-methylbenzo[e]benzimidazole-4,5-dione;2-propan-2-yl-3-(pyridin-2-ylmethyl)benzo[e]benzimidazole-4,5-dione;2-propan-2-yl-3-(pyridin-3-ylmethyl)benzo[e]benzimidazole-4,5-dione;2-propan-2-yl-3-(pyridin-4-ylmethyl)benzo[e]benzimidazole-4,5-dione with MolForge

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Related Compounds

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CID 144912177
2-(1,1-difluoroethyl)-3H-benzo[e]benzimidazole-4,5-dione;2-[(4-fluorophenoxy)methyl]-3-methylbenzo[e]benzimidazole-4,5-dione;2-propan-2-yl-3-(pyridin-2-ylmethyl)benzo[e]benzimidazole-4,5-dione;2-propan-2-yl-3-(pyridin-3-ylmethyl)benzo[e]benzimidazole-4,5-dione;2-propan-2-yl-3-(pyridin-4-ylmethyl)benzo[e]benzimidazole-4,5-dione
CID 157637136
2-[5-[3,5-bis(trifluoromethyl)phenyl]furan-2-yl]-5-methyl-4-phenyl-1H-imidazole;2-[2,5-dimethyl-1-[3-(trifluoromethyl)phenyl]pyrrol-3-yl]-5-methyl-4-phenyl-1H-imidazole;4-(4-fluorophenyl)-5-methyl-2-[5-[3-(trifluoromethoxy)phenyl]furan-2-yl]-1H-imidazole;5-methyl-4-phenyl-2-[5-[3-(trifluoromethoxy)phenyl]furan-2-yl]-1H-imidazole;5-methyl-4-phenyl-2-[1-[2-(trifluoromethyl)phenyl]pyrrol-3-yl]-1H-imidazole
CID 158033693
2-(1,1-difluoroethyl)-3H-benzo[e]benzimidazole-4,5-dione;2-[(4-fluorophenoxy)methyl]-3H-benzo[e]benzimidazole-4,5-dione;2-[(4-fluorophenoxy)methyl]-3-methylbenzo[e]benzimidazole-4,5-dione;2-propan-2-yl-3-(pyridin-3-ylmethyl)benzo[e]benzimidazole-4,5-dione;2-propan-2-yl-3-(pyridin-4-ylmethyl)benzo[e]benzimidazole-4,5-dione
CID 158111324
12-[(4,4-difluoropiperidin-1-yl)methyl]-4-(1H-indol-4-yl)-6-morpholin-4-yl-8-oxa-3,5,10-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene;12-[(4-fluoropiperidin-1-yl)methyl]-4-(1H-indol-4-yl)-6-morpholin-4-yl-8-oxa-3,5,10-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene;4-(1H-indol-4-yl)-6,12-dimorpholin-4-yl-8-oxa-3,5,10-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene;4-(1H-indol-4-yl)-11-methyl-6-morpholin-4-yl-8-oxa-3,5,10-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene
CID 158180516
ethyl 4-[4-(4-fluorophenyl)-5-(1H-pyrrolo[2,3-b]pyridin-4-yl)imidazol-1-yl]piperidine-1-carboxylate;4-[5-(4-fluorophenyl)-3-(furan-2-ylmethyl)imidazol-4-yl]-1H-pyrrolo[2,3-b]pyridine;4-[5-(4-fluorophenyl)-3-(furan-3-ylmethyl)imidazol-4-yl]-1H-pyrrolo[2,3-b]pyridine;4-[4-(4-fluorophenyl)-5-(1H-pyrrolo[2,3-b]pyridin-4-yl)imidazol-1-yl]-N,N-dimethylcyclohexan-1-amine;4-[5-(4-fluorophenyl)-3-[3-(trifluoromethoxy)propyl]imidazol-4-yl]-1H-pyrrolo[2,3-b]pyridine
CID 158403835
1-(3H-benzimidazol-5-yl)-4-(2-fluorophenyl)butane-1,4-dione;1-(3H-benzimidazol-5-yl)-4-[2-(trifluoromethyl)phenyl]butane-1,4-dione;1-(3H-benzimidazol-5-yl)-4-[3-(trifluoromethyl)phenyl]butane-1,4-dione;1-(3H-benzimidazol-5-yl)-4-[4-(trifluoromethyl)phenyl]butane-1,4-dione;1-(1H-indol-5-yl)-4-(4-methoxyphenyl)butane-1,4-dione;1-(1H-indol-5-yl)-4-phenylbutane-1,4-dione;1-(1H-indol-5-yl)-4-pyridin-2-ylbutane-1,4-dione;1-(1H-indol-5-yl)-4-pyridin-3-ylbutane-1,4-dione;1-(1H-indol-5-yl)-4-pyridin-4-ylbutane-1,4-dione
CID 160191476
[5-[[4-[4-(2-cyclopropylethoxy)-2-pyridinyl]pyrimidin-2-yl]amino]-1H-indol-2-yl]-(4-methylpiperazin-1-yl)methanone;[5-[[4-[4-(3,3-difluorobutan-2-yloxy)-2-pyridinyl]pyrimidin-2-yl]amino]-1H-indol-2-yl]-(4-methylpiperazin-1-yl)methanone;[5-[[4-[4-(4,4-difluoropentoxy)-2-pyridinyl]pyrimidin-2-yl]amino]-1H-indol-2-yl]-(4-methylpiperazin-1-yl)methanone;[5-[[4-[4-[[3-(2-methoxyethyl)imidazol-4-yl]methoxy]-2-pyridinyl]pyrimidin-2-yl]amino]-1H-indol-2-yl]-(4-methylpiperazin-1-yl)methanone
CID 160620005
1,3-benzoxazol-2-yl-[4-[2-(trifluoromethyl)phenyl]piperidin-1-yl]methanone;1H-imidazo[4,5-b]pyridin-2-yl-[4-[2-(trifluoromethyl)phenyl]piperidin-1-yl]methanone;(6-imidazol-1-yl-1H-pyrrolo[3,2-b]pyridin-2-yl)-[4-[2-(trifluoromethyl)phenyl]piperidin-1-yl]methanone;(6-methylpyridazin-3-yl)-[4-[2-(trifluoromethyl)phenyl]piperidin-1-yl]methanone;(1-methylpyrrolo[3,2-b]pyridin-3-yl)-[4-[2-(trifluoromethyl)phenyl]piperidin-1-yl]methanone;(5-methyl-1H-pyrrolo[3,2-b]pyridin-2-yl)-[4-[2-(trifluoromethyl)phenyl]piperidin-1-yl]methanone;(6-methyl-1H-pyrrolo[3,2-b]pyridin-2-yl)-[4-[2-(trifluoromethyl)phenyl]piperidin-1-yl]methanone;pyridin-3-yl-[4-[2-(trifluoromethyl)phenyl]piperidin-1-yl]methanone
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2,3-diethylbenzo[e]benzimidazole-4,5-dione;2,3-diethyl-7-fluorobenzo[e]benzimidazole-4,5-dione;2-(1,1-difluoroethyl)-3H-benzo[e]benzimidazole-4,5-dione;2,3-di(propan-2-yl)benzo[e]benzimidazole-4,5-dione;2-ethyl-7-fluoro-3-propan-2-ylbenzo[e]benzimidazole-4,5-dione;2-ethyl-3-propan-2-ylbenzo[e]benzimidazole-4,5-dione;methane;2-propan-2-yl-3-(pyridin-2-ylmethyl)benzo[e]benzimidazole-4,5-dione;2-propan-2-yl-3-(pyridin-3-ylmethyl)benzo[e]benzimidazole-4,5-dione;2-propan-2-yl-3-(pyridin-4-ylmethyl)benzo[e]benzimidazole-4,5-dione;2-pyridin-3-yl-3H-benzo[e]benzimidazole-4,5-dione
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Frequently Asked Questions

What is the IUPAC name of 2-(1,1-difluoroethyl)-3H-benzo[e]benzimidazole-4,5-dione;2-[(4-fluorophenoxy)methyl]-3H-benzo[e]benzimidazole-4,5-dione;2-[(4-fluorophenoxy)methyl]-3-methylbenzo[e]benzimidazole-4,5-dione;2-propan-2-yl-3-(pyridin-2-ylmethyl)benzo[e]benzimidazole-4,5-dione;2-propan-2-yl-3-(pyridin-3-ylmethyl)benzo[e]benzimidazole-4,5-dione;2-propan-2-yl-3-(pyridin-4-ylmethyl)benzo[e]benzimidazole-4,5-dione?
The IUPAC name of 2-(1,1-difluoroethyl)-3H-benzo[e]benzimidazole-4,5-dione;2-[(4-fluorophenoxy)methyl]-3H-benzo[e]benzimidazole-4,5-dione;2-[(4-fluorophenoxy)methyl]-3-methylbenzo[e]benzimidazole-4,5-dione;2-propan-2-yl-3-(pyridin-2-ylmethyl)benzo[e]benzimidazole-4,5-dione;2-propan-2-yl-3-(pyridin-3-ylmethyl)benzo[e]benzimidazole-4,5-dione;2-propan-2-yl-3-(pyridin-4-ylmethyl)benzo[e]benzimidazole-4,5-dione (CID 161373924) is 2-(1,1-difluoroethyl)-3H-benzo[e]benzimidazole-4,5-dione;2-[(4-fluorophenoxy)methyl]-3H-benzo[e]benzimidazole-4,5-dione;2-[(4-fluorophenoxy)methyl]-3-methylbenzo[e]benzimidazole-4,5-dione;2-propan-2-yl-3-(pyridin-2-ylmethyl)benzo[e]benzimidazole-4,5-dione;2-propan-2-yl-3-(pyridin-3-ylmethyl)benzo[e]benzimidazole-4,5-dione;2-propan-2-yl-3-(pyridin-4-ylmethyl)benzo[e]benzimidazole-4,5-dione.
What is the SMILES notation for 2-(1,1-difluoroethyl)-3H-benzo[e]benzimidazole-4,5-dione;2-[(4-fluorophenoxy)methyl]-3H-benzo[e]benzimidazole-4,5-dione;2-[(4-fluorophenoxy)methyl]-3-methylbenzo[e]benzimidazole-4,5-dione;2-propan-2-yl-3-(pyridin-2-ylmethyl)benzo[e]benzimidazole-4,5-dione;2-propan-2-yl-3-(pyridin-3-ylmethyl)benzo[e]benzimidazole-4,5-dione;2-propan-2-yl-3-(pyridin-4-ylmethyl)benzo[e]benzimidazole-4,5-dione?
The canonical SMILES for 2-(1,1-difluoroethyl)-3H-benzo[e]benzimidazole-4,5-dione;2-[(4-fluorophenoxy)methyl]-3H-benzo[e]benzimidazole-4,5-dione;2-[(4-fluorophenoxy)methyl]-3-methylbenzo[e]benzimidazole-4,5-dione;2-propan-2-yl-3-(pyridin-2-ylmethyl)benzo[e]benzimidazole-4,5-dione;2-propan-2-yl-3-(pyridin-3-ylmethyl)benzo[e]benzimidazole-4,5-dione;2-propan-2-yl-3-(pyridin-4-ylmethyl)benzo[e]benzimidazole-4,5-dione is CC(C)c1nc2c(n1Cc1ccccn1)C(=O)C(=O)c1ccccc1-2.CC(C)c1nc2c(n1Cc1cccnc1)C(=O)C(=O)c1ccccc1-2.CC(C)c1nc2c(n1Cc1ccncc1)C(=O)C(=O)c1ccccc1-2.CC(F)(F)c1nc2c([nH]1)C(=O)C(=O)c1ccccc1-2.Cn1c(COc2ccc(F)cc2)nc2c1C(=O)C(=O)c1ccccc1-2.O=C1C(=O)c2[nH]c(COc3ccc(F)cc3)nc2-c2ccccc21.
What is the InChIKey of 2-(1,1-difluoroethyl)-3H-benzo[e]benzimidazole-4,5-dione;2-[(4-fluorophenoxy)methyl]-3H-benzo[e]benzimidazole-4,5-dione;2-[(4-fluorophenoxy)methyl]-3-methylbenzo[e]benzimidazole-4,5-dione;2-propan-2-yl-3-(pyridin-2-ylmethyl)benzo[e]benzimidazole-4,5-dione;2-propan-2-yl-3-(pyridin-3-ylmethyl)benzo[e]benzimidazole-4,5-dione;2-propan-2-yl-3-(pyridin-4-ylmethyl)benzo[e]benzimidazole-4,5-dione?
The InChIKey is VQVGHKWCWSQTES-UHFFFAOYSA-N. The full InChI is InChI=1S/3C20H17N3O2.C19H13FN2O3.C18H11FN2O3.C13H8F2N2O2/c1-12(2)20-22-16-14-8-3-4-9-15(14)18(24)19(25)17(16)23(20)11-13-7-5-6-10-21-13;1-12(2)20-22-16-14-7-3-4-8-15(14)18(24)19(25)17(16)23(20)11-13-6-5-9-21-10-13;1-12(2)20-22-16-14-5-3-4-6-15(14)18(24)19(25)17(16)23(20)11-13-7-9-21-10-8-13;1-22-15(10-25-12-8-6-11(20)7-9-12)21-16-13-4-2-3-5-14(13)18(23)19(24)17(16)22;19-10-5-7-11(8-6-10)24-9-14-20-15-12-3-1-2-4-13(12)17(22)18(23)16(15)21-14;1-13(14,15)12-16-8-6-4-2-3-5-7(6)10(18)11(19)9(8)17-12/h3*3-10,12H,11H2,1-2H3;2-9H,10H2,1H3;1-8H,9H2,(H,20,21);2-5H,1H3,(H,16,17).
What are the key properties of 2-(1,1-difluoroethyl)-3H-benzo[e]benzimidazole-4,5-dione;2-[(4-fluorophenoxy)methyl]-3H-benzo[e]benzimidazole-4,5-dione;2-[(4-fluorophenoxy)methyl]-3-methylbenzo[e]benzimidazole-4,5-dione;2-propan-2-yl-3-(pyridin-2-ylmethyl)benzo[e]benzimidazole-4,5-dione;2-propan-2-yl-3-(pyridin-3-ylmethyl)benzo[e]benzimidazole-4,5-dione;2-propan-2-yl-3-(pyridin-4-ylmethyl)benzo[e]benzimidazole-4,5-dione?
2-(1,1-difluoroethyl)-3H-benzo[e]benzimidazole-4,5-dione;2-[(4-fluorophenoxy)methyl]-3H-benzo[e]benzimidazole-4,5-dione;2-[(4-fluorophenoxy)methyl]-3-methylbenzo[e]benzimidazole-4,5-dione;2-propan-2-yl-3-(pyridin-2-ylmethyl)benzo[e]benzimidazole-4,5-dione;2-propan-2-yl-3-(pyridin-3-ylmethyl)benzo[e]benzimidazole-4,5-dione;2-propan-2-yl-3-(pyridin-4-ylmethyl)benzo[e]benzimidazole-4,5-dione has a molecular weight of 1914.96 g/mol, XLogP of 19.41, 16 rotatable bonds, 2 hydrogen bond donors, and 27 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1,1-difluoroethyl)-3H-benzo[e]benzimidazole-4,5-dione;2-[(4-fluorophenoxy)methyl]-3H-benzo[e]benzimidazole-4,5-dione;2-[(4-fluorophenoxy)methyl]-3-methylbenzo[e]benzimidazole-4,5-dione;2-propan-2-yl-3-(pyridin-2-ylmethyl)benzo[e]benzimidazole-4,5-dione;2-propan-2-yl-3-(pyridin-3-ylmethyl)benzo[e]benzimidazole-4,5-dione;2-propan-2-yl-3-(pyridin-4-ylmethyl)benzo[e]benzimidazole-4,5-dione is sourced from PubChem (CID 161373924), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).