2-fluoro-4-(2-methyl-8,9,10,11-tetrahydro-3H-pyrrolo[3,2-a]phenanthridin-7-yl)phenol;N'-hydroxy-4-(8,9,10,11-tetrahydro-6H-pyrrolo[3,2-a]phenanthridin-7-yl)benzenecarboximidamide;methyl 4-(8,9,10,11-tetrahydro-3H-pyrazolo[4,5-a]phenanthridin-7-yl)benzoate;methyl 4-(8,9,10,11-tetrahydro-6H-pyrrolo[3,2-a]phenanthridin-7-yl)benzoate;4-(8,9,10,11-tetrahydro-3H-pyrazolo[4,5-a]phenanthridin-7-yl)benzamide

C110H96FN15O7 — CID 160667689

IUPAC2-fluoro-4-(2-methyl-8,9,10,11-tetrahydro-3H-pyrrolo[3,2-a]phenanthridin-7-yl)phenol;N'-hydroxy-4-(8,9,10,11-tetrahydro-6H-pyrrolo[3,2-a]phenanthridin-7-yl)benzenecarboximidamide;methyl 4-(8,9,10,11-tetrahydro-3H-pyrazolo[4,5-a]phenanthridin-7-yl)benzoate;methyl 4-(8,9,10,11-tetrahydro-6H-pyrrolo[3,2-a]phenanthridin-7-yl)benzoate;4-(8,9,10,11-tetrahydro-3H-pyrazolo[4,5-a]phenanthridin-7-yl)benzamide
SMILESCOC(=O)c1ccc(-c2[nH]c3ccc4nccc4c3c3c2CCCC3)cc1.COC(=O)c1ccc(-c2nc3ccc4[nH]ncc4c3c3c2CCCC3)cc1.Cc1cc2c(ccc3nc(-c4ccc(O)c(F)c4)c4c(c32)CCCC4)[nH]1.NC(=NO)c1ccc(-c2[nH]c3ccc4nccc4c3c3c2CCCC3)cc1.NC(=O)c1ccc(-c2nc3ccc4[nH]ncc4c3c3c2CCCC3)cc1
InChIInChI=1S/C23H20N2O2.C22H19FN2O.C22H20N4O.C22H19N3O2.C21H18N4O/c1-27-23(26)15-8-6-14(7-9-15)22-17-5-3-2-4-16(17)21-18-12-13-24-19(18)10-11-20(21)25-22;1-12-10-16-18(24-12)7-8-19-21(16)14-4-2-3-5-15(14)22(25-19)13-6-9-20(26)17(23)11-13;23-22(26-27)14-7-5-13(6-8-14)21-16-4-2-1-3-15(16)20-17-11-12-24-18(17)9-10-19(20)25-21;1-27-22(26)14-8-6-13(7-9-14)21-16-5-3-2-4-15(16)20-17-12-23-25-18(17)10-11-19(20)24-21;22-21(26)13-7-5-12(6-8-13)20-15-4-2-1-3-14(15)19-16-11-23-25-17(16)9-10-18(19)24-20/h6-13,25H,2-5H2,1H3;6-11,24,26H,2-5H2,1H3;5-12,25,27H,1-4H2,(H2,23,26);6-12H,2-5H2,1H3,(H,23,25);5-11H,1-4H2,(H2,22,26)(H,23,25)
InChIKeyXWJGVLJGUWSHDO-UHFFFAOYSA-N
MW1759.07 g/mol
LogP23.02
Rot. Bonds9

About 2-fluoro-4-(2-methyl-8,9,10,11-tetrahydro-3H-pyrrolo[3,2-a]phenanthridin-7-yl)phenol;N'-hydroxy-4-(8,9,10,11-tetrahydro-6H-pyrrolo[3,2-a]phenanthridin-7-yl)benzenecarboximidamide;methyl 4-(8,9,10,11-tetrahydro-3H-pyrazolo[4,5-a]phenanthridin-7-yl)benzoate;methyl 4-(8,9,10,11-tetrahydro-6H-pyrrolo[3,2-a]phenanthridin-7-yl)benzoate;4-(8,9,10,11-tetrahydro-3H-pyrazolo[4,5-a]phenanthridin-7-yl)benzamide

2-fluoro-4-(2-methyl-8,9,10,11-tetrahydro-3H-pyrrolo[3,2-a]phenanthridin-7-yl)phenol;N'-hydroxy-4-(8,9,10,11-tetrahydro-6H-pyrrolo[3,2-a]phenanthridin-7-yl)benzenecarboximidamide;methyl 4-(8,9,10,11-tetrahydro-3H-pyrazolo[4,5-a]phenanthridin-7-yl)benzoate;methyl 4-(8,9,10,11-tetrahydro-6H-pyrrolo[3,2-a]phenanthridin-7-yl)benzoate;4-(8,9,10,11-tetrahydro-3H-pyrazolo[4,5-a]phenanthridin-7-yl)benzamide (PubChem CID 160667689) has the molecular formula C110H96FN15O7 and a molecular weight of 1759.07 g/mol. Its IUPAC name is 2-fluoro-4-(2-methyl-8,9,10,11-tetrahydro-3H-pyrrolo[3,2-a]phenanthridin-7-yl)phenol;N'-hydroxy-4-(8,9,10,11-tetrahydro-6H-pyrrolo[3,2-a]phenanthridin-7-yl)benzenecarboximidamide;methyl 4-(8,9,10,11-tetrahydro-3H-pyrazolo[4,5-a]phenanthridin-7-yl)benzoate;methyl 4-(8,9,10,11-tetrahydro-6H-pyrrolo[3,2-a]phenanthridin-7-yl)benzoate;4-(8,9,10,11-tetrahydro-3H-pyrazolo[4,5-a]phenanthridin-7-yl)benzamide.

Molecular Properties

Compound Name2-fluoro-4-(2-methyl-8,9,10,11-tetrahydro-3H-pyrrolo[3,2-a]phenanthridin-7-yl)phenol;N'-hydroxy-4-(8,9,10,11-tetrahydro-6H-pyrrolo[3,2-a]phenanthridin-7-yl)benzenecarboximidamide;methyl 4-(8,9,10,11-tetrahydro-3H-pyrazolo[4,5-a]phenanthridin-7-yl)benzoate;methyl 4-(8,9,10,11-tetrahydro-6H-pyrrolo[3,2-a]phenanthridin-7-yl)benzoate;4-(8,9,10,11-tetrahydro-3H-pyrazolo[4,5-a]phenanthridin-7-yl)benzamide
PubChem CID160667689
Molecular FormulaC110H96FN15O7
Molecular Weight1759.07 g/mol
Exact Mass1757.76
IUPAC Name2-fluoro-4-(2-methyl-8,9,10,11-tetrahydro-3H-pyrrolo[3,2-a]phenanthridin-7-yl)phenol;N'-hydroxy-4-(8,9,10,11-tetrahydro-6H-pyrrolo[3,2-a]phenanthridin-7-yl)benzenecarboximidamide;methyl 4-(8,9,10,11-tetrahydro-3H-pyrazolo[4,5-a]phenanthridin-7-yl)benzoate;methyl 4-(8,9,10,11-tetrahydro-6H-pyrrolo[3,2-a]phenanthridin-7-yl)benzoate;4-(8,9,10,11-tetrahydro-3H-pyrazolo[4,5-a]phenanthridin-7-yl)benzamide
SMILESCOC(=O)c1ccc(-c2[nH]c3ccc4nccc4c3c3c2CCCC3)cc1.COC(=O)c1ccc(-c2nc3ccc4[nH]ncc4c3c3c2CCCC3)cc1.Cc1cc2c(ccc3nc(-c4ccc(O)c(F)c4)c4c(c32)CCCC4)[nH]1.NC(=NO)c1ccc(-c2[nH]c3ccc4nccc4c3c3c2CCCC3)cc1.NC(=O)c1ccc(-c2nc3ccc4[nH]ncc4c3c3c2CCCC3)cc1
InChIInChI=1S/C23H20N2O2.C22H19FN2O.C22H20N4O.C22H19N3O2.C21H18N4O/c1-27-23(26)15-8-6-14(7-9-15)22-17-5-3-2-4-16(17)21-18-12-13-24-19(18)10-11-20(21)25-22;1-12-10-16-18(24-12)7-8-19-21(16)14-4-2-3-5-15(14)22(25-19)13-6-9-20(26)17(23)11-13;23-22(26-27)14-7-5-13(6-8-14)21-16-4-2-1-3-15(16)20-17-11-12-24-18(17)9-10-19(20)25-21;1-27-22(26)14-8-6-13(7-9-14)21-16-5-3-2-4-15(16)20-17-12-23-25-18(17)10-11-19(20)24-21;22-21(26)13-7-5-12(6-8-13)20-15-4-2-1-3-14(15)19-16-11-23-25-17(16)9-10-18(19)24-20/h6-13,25H,2-5H2,1H3;6-11,24,26H,2-5H2,1H3;5-12,25,27H,1-4H2,(H2,23,26);6-12H,2-5H2,1H3,(H,23,25);5-11H,1-4H2,(H2,22,26)(H,23,25)
InChIKeyXWJGVLJGUWSHDO-UHFFFAOYSA-N
XLogP23.02
TPSA343.71 Ų
H-Bond Donors9
H-Bond Acceptors15
Rotatable Bonds9
Heavy Atoms133
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5001759.07
LogP ≤ 523.02
H-Bond Donors ≤ 59
H-Bond Acceptors ≤ 1015

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'imine_2', 'substructure': 'N/A'}, {'alert_name': 'oxime_1', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

Analyze 2-fluoro-4-(2-methyl-8,9,10,11-tetrahydro-3H-pyrrolo[3,2-a]phenanthridin-7-yl)phenol;N'-hydroxy-4-(8,9,10,11-tetrahydro-6H-pyrrolo[3,2-a]phenanthridin-7-yl)benzenecarboximidamide;methyl 4-(8,9,10,11-tetrahydro-3H-pyrazolo[4,5-a]phenanthridin-7-yl)benzoate;methyl 4-(8,9,10,11-tetrahydro-6H-pyrrolo[3,2-a]phenanthridin-7-yl)benzoate;4-(8,9,10,11-tetrahydro-3H-pyrazolo[4,5-a]phenanthridin-7-yl)benzamide with MolForge

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Related Compounds

2-fluoro-4-(1-methyl-8,9,10,11-tetrahydro-2H-pyrazolo[4,3-a]phenanthridin-7-yl)phenol;4-(3-oxa-8,13-diazatetracyclo[7.7.0.02,6.012,16]hexadeca-1,6,9,11,13,15-hexaen-7-yl)phenol;N-[4-(8,9,10,11-tetrahydro-3H-pyrazolo[4,5-a]phenanthridin-7-yl)phenyl]acetamide;4-(8,9,10,11-tetrahydro-6H-pyrrolo[3,2-a]phenanthridin-7-yl)benzonitrile;N-[4-(8,9,10,11-tetrahydro-6H-pyrrolo[3,2-a]phenanthridin-7-yl)phenyl]acetamide
CID 157085335
2-fluoro-4-(2-methyl-8,9,10,11-tetrahydro-3H-pyrrolo[3,2-a]phenanthridin-7-yl)phenol;4-[1-(2-hydroxyethanimidoyl)-8,9,10,11-tetrahydro-3H-pyrazolo[4,3-a]phenanthridin-7-yl]phenol;N'-hydroxy-4-(8,9,10,11-tetrahydro-3H-pyrazolo[4,5-a]phenanthridin-7-yl)benzenecarboximidamide;4-(8,9,10,11-tetrahydro-3H-pyrazolo[4,5-a]phenanthridin-7-yl)benzenecarboximidamide;4-(8,9,10,11-tetrahydro-6H-pyrrolo[3,2-a]phenanthridin-7-yl)benzenecarboximidamide;dihydrochloride
CID 158072757
2-[(dimethylamino)methyl]-4-(8,9,10,11-tetrahydro-3H-pyrazolo[4,5-a]phenanthridin-7-yl)phenol;7-(6-fluoro-3-pyridinyl)-8,9,10,11-tetrahydro-3H-pyrazolo[4,5-a]phenanthridine;2-iodo-4-(8,9,10,11-tetrahydro-3H-pyrazolo[4,5-a]phenanthridin-7-yl)phenol;4-(8,9,10,11-tetrahydro-3H-pyrazolo[4,5-a]phenanthridin-7-yl)benzoic acid
CID 158148373
4-(9,14-diazapentacyclo[11.8.0.02,10.03,8.016,21]henicosa-1(13),2(10),3,5,7,11,14,16(21)-octaen-15-yl)phenol;2-fluoro-4-(8,9,10,11-tetrahydro-6H-pyrrolo[3,2-a]phenanthridin-7-yl)phenol;4-(3-methyl-8,9,10,11-tetrahydropyrrolo[3,2-a]phenanthridin-7-yl)phenol;7-pyridin-4-yl-8,9,10,11-tetrahydro-6H-pyrrolo[3,2-a]phenanthridine;5-(8,9,10,11-tetrahydro-3H-pyrazolo[4,5-a]phenanthridin-7-yl)-1H-pyridin-2-one
CID 158538272
4-(9,14-diazapentacyclo[11.8.0.02,10.03,8.016,21]henicosa-1(13),2(10),3,5,7,11,14,16(21)-octaen-15-yl)phenol;2-fluoro-4-(8,9,10,11-tetrahydro-3H-pyrazolo[4,5-a]phenanthridin-7-yl)phenol;4-(3-methyl-8,9,10,11-tetrahydropyrrolo[3,2-a]phenanthridin-7-yl)phenol;7-pyridin-4-yl-8,9,10,11-tetrahydro-6H-pyrrolo[3,2-a]phenanthridine;5-(8,9,10,11-tetrahydro-3H-pyrazolo[4,5-a]phenanthridin-7-yl)-1H-pyridin-2-one
CID 159220194
2,3-difluoro-4-(8,9,10,11-tetrahydro-6H-pyrrolo[3,2-a]phenanthridin-7-yl)phenol;2-fluoro-4-(2-methyl-8,9,10,11-tetrahydro-3H-pyrrolo[3,2-a]phenanthridin-7-yl)phenol;N'-hydroxy-4-(8,9,10,11-tetrahydro-6H-pyrrolo[3,2-a]phenanthridin-7-yl)benzenecarboximidamide;methyl 4-(8,9,10,11-tetrahydro-6H-pyrrolo[3,2-a]phenanthridin-7-yl)benzoate;4-(8,9,10,11-tetrahydro-6H-pyrrolo[3,2-a]phenanthridin-7-yl)benzamide
CID 159683379
ethyl 8,9,10,11-tetrahydro-3H-pyrazolo[4,5-a]phenanthridine-7-carboxylate;4-[3-(2-hydroxyethyl)-8,9,10,11-tetrahydropyrazolo[4,5-a]phenanthridin-7-yl]phenol;4-(1-isocyano-8,9,10,11-tetrahydro-6H-pyrrolo[3,2-a]phenanthridin-7-yl)phenol;4-(7,8,9,10-tetrahydrophenanthridin-6-yl)phenol;4-(6,7,8,9-tetrahydro-4H-pyrrolo[3,2-c]phenanthridin-5-yl)phenol
CID 160691775
2,3-difluoro-4-(8,9,10,11-tetrahydro-6H-pyrrolo[3,2-a]phenanthridin-7-yl)phenol;11-(5-methyl-1H-pyrazol-4-yl)-4,5,10-triazatetracyclo[7.7.0.02,6.012,16]hexadeca-1(9),2(6),3,7,10,12(16)-hexaene;9-(5-methyl-1H-pyrazol-4-yl)-10,15,16-triazatetracyclo[9.7.0.02,8.014,18]octadeca-1(11),2(8),9,12,14(18),16-hexaene;11-(5-methyl-1H-pyrazol-4-yl)-4,5,10-triazatetracyclo[7.6.0.02,6.012,15]pentadeca-1(9),2(6),3,7,10,12(15)-hexaene;4-(8,9,10,11-tetrahydro-6H-pyrrolo[3,2-a]phenanthridin-7-yl)benzamide
CID 161163441
2-fluoro-4-(1-methyl-8,9,10,11-tetrahydro-2H-pyrazolo[4,3-a]phenanthridin-7-yl)phenol;methyl 4-(8,9,10,11-tetrahydro-3H-pyrazolo[4,5-a]phenanthridin-7-yl)benzoate;4-(3-oxa-8,13-diazatetracyclo[7.7.0.02,6.012,16]hexadeca-1,6,9,11,13,15-hexaen-7-yl)phenol;4-(8,9,10,11-tetrahydro-3H-pyrazolo[4,5-a]phenanthridin-7-yl)benzamide;4-(8,9,10,11-tetrahydro-6H-pyrrolo[3,2-a]phenanthridin-7-yl)benzonitrile
CID 161189744
4-[1-(2-hydroxyethanimidoyl)-8,9,10,11-tetrahydro-3H-pyrazolo[4,3-a]phenanthridin-7-yl]phenol;N'-hydroxy-4-(8,9,10,11-tetrahydro-3H-pyrazolo[4,5-a]phenanthridin-7-yl)benzenecarboximidamide;N-[4-(8,9,10,11-tetrahydro-3H-pyrazolo[4,5-a]phenanthridin-7-yl)phenyl]acetamide;4-(8,9,10,11-tetrahydro-6H-pyrrolo[3,2-a]phenanthridin-7-yl)benzenecarboximidamide;N-[4-(8,9,10,11-tetrahydro-6H-pyrrolo[3,2-a]phenanthridin-7-yl)phenyl]acetamide;hydrochloride
CID 161709456
2-[(dimethylamino)methyl]-4-(8,9,10,11-tetrahydro-3H-pyrazolo[4,5-a]phenanthridin-7-yl)phenol;7-(6-fluoro-3-pyridinyl)-8,9,10,11-tetrahydro-3H-pyrazolo[4,5-a]phenanthridine;7-(4-hydroxyphenyl)-8,9,10,11-tetrahydro-6H-pyrrolo[3,2-a]phenanthridine-9-carbonitrile;2-iodo-4-(8,9,10,11-tetrahydro-3H-pyrazolo[4,5-a]phenanthridin-7-yl)phenol;4-(8,9,10,11-tetrahydro-3H-pyrazolo[4,5-a]phenanthridin-7-yl)benzoic acid
CID 163421653
7-(4-fluorophenyl)-8,9,10,11-tetrahydro-3H-pyrazolo[4,5-a]phenanthridine;7-(4-fluorophenyl)-8,9,10,11-tetrahydro-6H-pyrrolo[3,2-a]phenanthridine;[7-(4-hydroxyphenyl)-8,9,10,11-tetrahydro-6H-pyrrolo[3,2-a]phenanthridin-2-yl] formate;7-phenyl-8,9,10,11-tetrahydro-3H-pyrazolo[4,5-a]phenanthridine;7-phenyl-8,9,10,11-tetrahydro-6H-pyrrolo[3,2-a]phenanthridine
CID 163563463

Frequently Asked Questions

What is the IUPAC name of 2-fluoro-4-(2-methyl-8,9,10,11-tetrahydro-3H-pyrrolo[3,2-a]phenanthridin-7-yl)phenol;N'-hydroxy-4-(8,9,10,11-tetrahydro-6H-pyrrolo[3,2-a]phenanthridin-7-yl)benzenecarboximidamide;methyl 4-(8,9,10,11-tetrahydro-3H-pyrazolo[4,5-a]phenanthridin-7-yl)benzoate;methyl 4-(8,9,10,11-tetrahydro-6H-pyrrolo[3,2-a]phenanthridin-7-yl)benzoate;4-(8,9,10,11-tetrahydro-3H-pyrazolo[4,5-a]phenanthridin-7-yl)benzamide?
The IUPAC name of 2-fluoro-4-(2-methyl-8,9,10,11-tetrahydro-3H-pyrrolo[3,2-a]phenanthridin-7-yl)phenol;N'-hydroxy-4-(8,9,10,11-tetrahydro-6H-pyrrolo[3,2-a]phenanthridin-7-yl)benzenecarboximidamide;methyl 4-(8,9,10,11-tetrahydro-3H-pyrazolo[4,5-a]phenanthridin-7-yl)benzoate;methyl 4-(8,9,10,11-tetrahydro-6H-pyrrolo[3,2-a]phenanthridin-7-yl)benzoate;4-(8,9,10,11-tetrahydro-3H-pyrazolo[4,5-a]phenanthridin-7-yl)benzamide (CID 160667689) is 2-fluoro-4-(2-methyl-8,9,10,11-tetrahydro-3H-pyrrolo[3,2-a]phenanthridin-7-yl)phenol;N'-hydroxy-4-(8,9,10,11-tetrahydro-6H-pyrrolo[3,2-a]phenanthridin-7-yl)benzenecarboximidamide;methyl 4-(8,9,10,11-tetrahydro-3H-pyrazolo[4,5-a]phenanthridin-7-yl)benzoate;methyl 4-(8,9,10,11-tetrahydro-6H-pyrrolo[3,2-a]phenanthridin-7-yl)benzoate;4-(8,9,10,11-tetrahydro-3H-pyrazolo[4,5-a]phenanthridin-7-yl)benzamide.
What is the SMILES notation for 2-fluoro-4-(2-methyl-8,9,10,11-tetrahydro-3H-pyrrolo[3,2-a]phenanthridin-7-yl)phenol;N'-hydroxy-4-(8,9,10,11-tetrahydro-6H-pyrrolo[3,2-a]phenanthridin-7-yl)benzenecarboximidamide;methyl 4-(8,9,10,11-tetrahydro-3H-pyrazolo[4,5-a]phenanthridin-7-yl)benzoate;methyl 4-(8,9,10,11-tetrahydro-6H-pyrrolo[3,2-a]phenanthridin-7-yl)benzoate;4-(8,9,10,11-tetrahydro-3H-pyrazolo[4,5-a]phenanthridin-7-yl)benzamide?
The canonical SMILES for 2-fluoro-4-(2-methyl-8,9,10,11-tetrahydro-3H-pyrrolo[3,2-a]phenanthridin-7-yl)phenol;N'-hydroxy-4-(8,9,10,11-tetrahydro-6H-pyrrolo[3,2-a]phenanthridin-7-yl)benzenecarboximidamide;methyl 4-(8,9,10,11-tetrahydro-3H-pyrazolo[4,5-a]phenanthridin-7-yl)benzoate;methyl 4-(8,9,10,11-tetrahydro-6H-pyrrolo[3,2-a]phenanthridin-7-yl)benzoate;4-(8,9,10,11-tetrahydro-3H-pyrazolo[4,5-a]phenanthridin-7-yl)benzamide is COC(=O)c1ccc(-c2[nH]c3ccc4nccc4c3c3c2CCCC3)cc1.COC(=O)c1ccc(-c2nc3ccc4[nH]ncc4c3c3c2CCCC3)cc1.Cc1cc2c(ccc3nc(-c4ccc(O)c(F)c4)c4c(c32)CCCC4)[nH]1.NC(=NO)c1ccc(-c2[nH]c3ccc4nccc4c3c3c2CCCC3)cc1.NC(=O)c1ccc(-c2nc3ccc4[nH]ncc4c3c3c2CCCC3)cc1.
What is the InChIKey of 2-fluoro-4-(2-methyl-8,9,10,11-tetrahydro-3H-pyrrolo[3,2-a]phenanthridin-7-yl)phenol;N'-hydroxy-4-(8,9,10,11-tetrahydro-6H-pyrrolo[3,2-a]phenanthridin-7-yl)benzenecarboximidamide;methyl 4-(8,9,10,11-tetrahydro-3H-pyrazolo[4,5-a]phenanthridin-7-yl)benzoate;methyl 4-(8,9,10,11-tetrahydro-6H-pyrrolo[3,2-a]phenanthridin-7-yl)benzoate;4-(8,9,10,11-tetrahydro-3H-pyrazolo[4,5-a]phenanthridin-7-yl)benzamide?
The InChIKey is XWJGVLJGUWSHDO-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H20N2O2.C22H19FN2O.C22H20N4O.C22H19N3O2.C21H18N4O/c1-27-23(26)15-8-6-14(7-9-15)22-17-5-3-2-4-16(17)21-18-12-13-24-19(18)10-11-20(21)25-22;1-12-10-16-18(24-12)7-8-19-21(16)14-4-2-3-5-15(14)22(25-19)13-6-9-20(26)17(23)11-13;23-22(26-27)14-7-5-13(6-8-14)21-16-4-2-1-3-15(16)20-17-11-12-24-18(17)9-10-19(20)25-21;1-27-22(26)14-8-6-13(7-9-14)21-16-5-3-2-4-15(16)20-17-12-23-25-18(17)10-11-19(20)24-21;22-21(26)13-7-5-12(6-8-13)20-15-4-2-1-3-14(15)19-16-11-23-25-17(16)9-10-18(19)24-20/h6-13,25H,2-5H2,1H3;6-11,24,26H,2-5H2,1H3;5-12,25,27H,1-4H2,(H2,23,26);6-12H,2-5H2,1H3,(H,23,25);5-11H,1-4H2,(H2,22,26)(H,23,25).
What are the key properties of 2-fluoro-4-(2-methyl-8,9,10,11-tetrahydro-3H-pyrrolo[3,2-a]phenanthridin-7-yl)phenol;N'-hydroxy-4-(8,9,10,11-tetrahydro-6H-pyrrolo[3,2-a]phenanthridin-7-yl)benzenecarboximidamide;methyl 4-(8,9,10,11-tetrahydro-3H-pyrazolo[4,5-a]phenanthridin-7-yl)benzoate;methyl 4-(8,9,10,11-tetrahydro-6H-pyrrolo[3,2-a]phenanthridin-7-yl)benzoate;4-(8,9,10,11-tetrahydro-3H-pyrazolo[4,5-a]phenanthridin-7-yl)benzamide?
2-fluoro-4-(2-methyl-8,9,10,11-tetrahydro-3H-pyrrolo[3,2-a]phenanthridin-7-yl)phenol;N'-hydroxy-4-(8,9,10,11-tetrahydro-6H-pyrrolo[3,2-a]phenanthridin-7-yl)benzenecarboximidamide;methyl 4-(8,9,10,11-tetrahydro-3H-pyrazolo[4,5-a]phenanthridin-7-yl)benzoate;methyl 4-(8,9,10,11-tetrahydro-6H-pyrrolo[3,2-a]phenanthridin-7-yl)benzoate;4-(8,9,10,11-tetrahydro-3H-pyrazolo[4,5-a]phenanthridin-7-yl)benzamide has a molecular weight of 1759.07 g/mol, XLogP of 23.02, 9 rotatable bonds, 9 hydrogen bond donors, and 15 hydrogen bond acceptors.
Where does this data come from?
All data for 2-fluoro-4-(2-methyl-8,9,10,11-tetrahydro-3H-pyrrolo[3,2-a]phenanthridin-7-yl)phenol;N'-hydroxy-4-(8,9,10,11-tetrahydro-6H-pyrrolo[3,2-a]phenanthridin-7-yl)benzenecarboximidamide;methyl 4-(8,9,10,11-tetrahydro-3H-pyrazolo[4,5-a]phenanthridin-7-yl)benzoate;methyl 4-(8,9,10,11-tetrahydro-6H-pyrrolo[3,2-a]phenanthridin-7-yl)benzoate;4-(8,9,10,11-tetrahydro-3H-pyrazolo[4,5-a]phenanthridin-7-yl)benzamide is sourced from PubChem (CID 160667689), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).