N-[(E)-(5-bromo-2-hydroxyphenyl)methylideneamino]-3-hydroxynaphthalene-2-carboxamide;N-[(E)-(5-chloro-2-hydroxyphenyl)methylideneamino]-3-hydroxynaphthalene-2-carboxamide;N-[(E)-(2,5-dihydroxyphenyl)methylideneamino]-3-hydroxynaphthalene-2-carboxamide;3-hydroxy-N-[(E)-(2-hydroxy-5-nitrophenyl)methylideneamino]naphthalene-2-carboxamide;3-hydroxy-N-[(E)-(2-hydroxyphenyl)methylideneamino]naphthalene-2-carboxamide

C90H67BrClN11O18 — CID 172917708

IUPACN-[(E)-(5-bromo-2-hydroxyphenyl)methylideneamino]-3-hydroxynaphthalene-2-carboxamide;N-[(E)-(5-chloro-2-hydroxyphenyl)methylideneamino]-3-hydroxynaphthalene-2-carboxamide;N-[(E)-(2,5-dihydroxyphenyl)methylideneamino]-3-hydroxynaphthalene-2-carboxamide;3-hydroxy-N-[(E)-(2-hydroxy-5-nitrophenyl)methylideneamino]naphthalene-2-carboxamide;3-hydroxy-N-[(E)-(2-hydroxyphenyl)methylideneamino]naphthalene-2-carboxamide
SMILESO=C(N/N=C/c1cc(Br)ccc1O)c1cc2ccccc2cc1O.O=C(N/N=C/c1cc(Cl)ccc1O)c1cc2ccccc2cc1O.O=C(N/N=C/c1cc(O)ccc1O)c1cc2ccccc2cc1O.O=C(N/N=C/c1cc([N+](=O)[O-])ccc1O)c1cc2ccccc2cc1O.O=C(N/N=C/c1ccccc1O)c1cc2ccccc2cc1O
InChIInChI=1S/C18H13BrN2O3.C18H13ClN2O3.C18H13N3O5.C18H14N2O4.C18H14N2O3/c2*19-14-5-6-16(22)13(7-14)10-20-21-18(24)15-8-11-3-1-2-4-12(11)9-17(15)23;22-16-6-5-14(21(25)26)7-13(16)10-19-20-18(24)15-8-11-3-1-2-4-12(11)9-17(15)23;21-14-5-6-16(22)13(7-14)10-19-20-18(24)15-8-11-3-1-2-4-12(11)9-17(15)23;21-16-8-4-3-7-14(16)11-19-20-18(23)15-9-12-5-1-2-6-13(12)10-17(15)22/h2*1-10,22-23H,(H,21,24);1-10,22-23H,(H,20,24);1-10,21-23H,(H,20,24);1-11,21-22H,(H,20,23)/b2*20-10+;2*19-10+;19-11+
InChIKeyJLUFECTVCFQJDZ-QHVOENNSSA-N
MW1705.94 g/mol
LogP16.10
Rot. Bonds16

About N-[(E)-(5-bromo-2-hydroxyphenyl)methylideneamino]-3-hydroxynaphthalene-2-carboxamide;N-[(E)-(5-chloro-2-hydroxyphenyl)methylideneamino]-3-hydroxynaphthalene-2-carboxamide;N-[(E)-(2,5-dihydroxyphenyl)methylideneamino]-3-hydroxynaphthalene-2-carboxamide;3-hydroxy-N-[(E)-(2-hydroxy-5-nitrophenyl)methylideneamino]naphthalene-2-carboxamide;3-hydroxy-N-[(E)-(2-hydroxyphenyl)methylideneamino]naphthalene-2-carboxamide

N-[(E)-(5-bromo-2-hydroxyphenyl)methylideneamino]-3-hydroxynaphthalene-2-carboxamide;N-[(E)-(5-chloro-2-hydroxyphenyl)methylideneamino]-3-hydroxynaphthalene-2-carboxamide;N-[(E)-(2,5-dihydroxyphenyl)methylideneamino]-3-hydroxynaphthalene-2-carboxamide;3-hydroxy-N-[(E)-(2-hydroxy-5-nitrophenyl)methylideneamino]naphthalene-2-carboxamide;3-hydroxy-N-[(E)-(2-hydroxyphenyl)methylideneamino]naphthalene-2-carboxamide (PubChem CID 172917708) has the molecular formula C90H67BrClN11O18 and a molecular weight of 1705.94 g/mol. Its IUPAC name is N-[(E)-(5-bromo-2-hydroxyphenyl)methylideneamino]-3-hydroxynaphthalene-2-carboxamide;N-[(E)-(5-chloro-2-hydroxyphenyl)methylideneamino]-3-hydroxynaphthalene-2-carboxamide;N-[(E)-(2,5-dihydroxyphenyl)methylideneamino]-3-hydroxynaphthalene-2-carboxamide;3-hydroxy-N-[(E)-(2-hydroxy-5-nitrophenyl)methylideneamino]naphthalene-2-carboxamide;3-hydroxy-N-[(E)-(2-hydroxyphenyl)methylideneamino]naphthalene-2-carboxamide.

Molecular Properties

Compound NameN-[(E)-(5-bromo-2-hydroxyphenyl)methylideneamino]-3-hydroxynaphthalene-2-carboxamide;N-[(E)-(5-chloro-2-hydroxyphenyl)methylideneamino]-3-hydroxynaphthalene-2-carboxamide;N-[(E)-(2,5-dihydroxyphenyl)methylideneamino]-3-hydroxynaphthalene-2-carboxamide;3-hydroxy-N-[(E)-(2-hydroxy-5-nitrophenyl)methylideneamino]naphthalene-2-carboxamide;3-hydroxy-N-[(E)-(2-hydroxyphenyl)methylideneamino]naphthalene-2-carboxamide
PubChem CID172917708
Molecular FormulaC90H67BrClN11O18
Molecular Weight1705.94 g/mol
Exact Mass1703.35
IUPAC NameN-[(E)-(5-bromo-2-hydroxyphenyl)methylideneamino]-3-hydroxynaphthalene-2-carboxamide;N-[(E)-(5-chloro-2-hydroxyphenyl)methylideneamino]-3-hydroxynaphthalene-2-carboxamide;N-[(E)-(2,5-dihydroxyphenyl)methylideneamino]-3-hydroxynaphthalene-2-carboxamide;3-hydroxy-N-[(E)-(2-hydroxy-5-nitrophenyl)methylideneamino]naphthalene-2-carboxamide;3-hydroxy-N-[(E)-(2-hydroxyphenyl)methylideneamino]naphthalene-2-carboxamide
SMILESO=C(N/N=C/c1cc(Br)ccc1O)c1cc2ccccc2cc1O.O=C(N/N=C/c1cc(Cl)ccc1O)c1cc2ccccc2cc1O.O=C(N/N=C/c1cc(O)ccc1O)c1cc2ccccc2cc1O.O=C(N/N=C/c1cc([N+](=O)[O-])ccc1O)c1cc2ccccc2cc1O.O=C(N/N=C/c1ccccc1O)c1cc2ccccc2cc1O
InChIInChI=1S/C18H13BrN2O3.C18H13ClN2O3.C18H13N3O5.C18H14N2O4.C18H14N2O3/c2*19-14-5-6-16(22)13(7-14)10-20-21-18(24)15-8-11-3-1-2-4-12(11)9-17(15)23;22-16-6-5-14(21(25)26)7-13(16)10-19-20-18(24)15-8-11-3-1-2-4-12(11)9-17(15)23;21-14-5-6-16(22)13(7-14)10-19-20-18(24)15-8-11-3-1-2-4-12(11)9-17(15)23;21-16-8-4-3-7-14(16)11-19-20-18(23)15-9-12-5-1-2-6-13(12)10-17(15)22/h2*1-10,22-23H,(H,21,24);1-10,22-23H,(H,20,24);1-10,21-23H,(H,20,24);1-11,21-22H,(H,20,23)/b2*20-10+;2*19-10+;19-11+
InChIKeyJLUFECTVCFQJDZ-QHVOENNSSA-N
XLogP16.10
TPSA472.97 Ų
H-Bond Donors16
H-Bond Acceptors23
Rotatable Bonds16
Heavy Atoms121
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5001705.94
LogP ≤ 516.10
H-Bond Donors ≤ 516
H-Bond Acceptors ≤ 1023

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hzone_phenol_A(479)', 'substructure': 'N/A'}, {'alert_name': 'hzone_acyl_naphthol(22)', 'substructure': 'N/A'}, {'alert_name': 'hydroquinone', 'substructure': 'N/A'}, {'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'nitro_group', 'substructure': 'N/A'}

Analyze N-[(E)-(5-bromo-2-hydroxyphenyl)methylideneamino]-3-hydroxynaphthalene-2-carboxamide;N-[(E)-(5-chloro-2-hydroxyphenyl)methylideneamino]-3-hydroxynaphthalene-2-carboxamide;N-[(E)-(2,5-dihydroxyphenyl)methylideneamino]-3-hydroxynaphthalene-2-carboxamide;3-hydroxy-N-[(E)-(2-hydroxy-5-nitrophenyl)methylideneamino]naphthalene-2-carboxamide;3-hydroxy-N-[(E)-(2-hydroxyphenyl)methylideneamino]naphthalene-2-carboxamide with MolForge

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Related Compounds

3-hydroxy-N-[(2-hydroxy-5-nitrophenyl)methylideneamino]naphthalene-2-carboxamide
CID 3101754
2,4-dihydroxy-N-[(2-hydroxy-5-nitrophenyl)methylideneamino]benzamide
CID 4686004
N-[[5-bromo-2-[(3-nitrophenyl)methoxy]phenyl]methylideneamino]-3-hydroxynaphthalene-2-carboxamide
CID 3506189
2-hydroxy-N-[(2-hydroxy-5-nitrophenyl)methylideneamino]-5-nitrobenzamide
CID 3358963
N-[(E)-(5-bromo-2-hydroxyphenyl)methylideneamino]-5-chloro-2-hydroxybenzamide
CID 135615369
N-[(Z)-(2-hydroxy-5-nitrophenyl)methylideneamino]naphthalene-1-carboxamide
CID 135830603
3-hydroxy-N-[(E)-(2-nitrophenyl)methylideneamino]naphthalene-2-carboxamide
CID 6870532
5-chloro-N-[(2-hydroxy-5-nitrophenyl)methylideneamino]-2-methoxybenzamide
CID 4134120
N-[[2-[(2,4-dichlorophenyl)methoxy]phenyl]methylideneamino]-2-hydroxy-5-nitrobenzamide
CID 75210800
[4-bromo-2-[(Z)-[(3-hydroxynaphthalene-2-carbonyl)hydrazinylidene]methyl]phenyl] 4-chlorobenzoate
CID 6082005
N-[(Z)-(5-chloro-2-hydroxyphenyl)methylideneamino]-2-hydroxybenzamide
CID 135641867
3-hydroxy-N-[[2-[(3-nitrophenyl)methoxy]phenyl]methylideneamino]naphthalene-2-carboxamide
CID 5137761

Frequently Asked Questions

What is the IUPAC name of N-[(E)-(5-bromo-2-hydroxyphenyl)methylideneamino]-3-hydroxynaphthalene-2-carboxamide;N-[(E)-(5-chloro-2-hydroxyphenyl)methylideneamino]-3-hydroxynaphthalene-2-carboxamide;N-[(E)-(2,5-dihydroxyphenyl)methylideneamino]-3-hydroxynaphthalene-2-carboxamide;3-hydroxy-N-[(E)-(2-hydroxy-5-nitrophenyl)methylideneamino]naphthalene-2-carboxamide;3-hydroxy-N-[(E)-(2-hydroxyphenyl)methylideneamino]naphthalene-2-carboxamide?
The IUPAC name of N-[(E)-(5-bromo-2-hydroxyphenyl)methylideneamino]-3-hydroxynaphthalene-2-carboxamide;N-[(E)-(5-chloro-2-hydroxyphenyl)methylideneamino]-3-hydroxynaphthalene-2-carboxamide;N-[(E)-(2,5-dihydroxyphenyl)methylideneamino]-3-hydroxynaphthalene-2-carboxamide;3-hydroxy-N-[(E)-(2-hydroxy-5-nitrophenyl)methylideneamino]naphthalene-2-carboxamide;3-hydroxy-N-[(E)-(2-hydroxyphenyl)methylideneamino]naphthalene-2-carboxamide (CID 172917708) is N-[(E)-(5-bromo-2-hydroxyphenyl)methylideneamino]-3-hydroxynaphthalene-2-carboxamide;N-[(E)-(5-chloro-2-hydroxyphenyl)methylideneamino]-3-hydroxynaphthalene-2-carboxamide;N-[(E)-(2,5-dihydroxyphenyl)methylideneamino]-3-hydroxynaphthalene-2-carboxamide;3-hydroxy-N-[(E)-(2-hydroxy-5-nitrophenyl)methylideneamino]naphthalene-2-carboxamide;3-hydroxy-N-[(E)-(2-hydroxyphenyl)methylideneamino]naphthalene-2-carboxamide.
What is the SMILES notation for N-[(E)-(5-bromo-2-hydroxyphenyl)methylideneamino]-3-hydroxynaphthalene-2-carboxamide;N-[(E)-(5-chloro-2-hydroxyphenyl)methylideneamino]-3-hydroxynaphthalene-2-carboxamide;N-[(E)-(2,5-dihydroxyphenyl)methylideneamino]-3-hydroxynaphthalene-2-carboxamide;3-hydroxy-N-[(E)-(2-hydroxy-5-nitrophenyl)methylideneamino]naphthalene-2-carboxamide;3-hydroxy-N-[(E)-(2-hydroxyphenyl)methylideneamino]naphthalene-2-carboxamide?
The canonical SMILES for N-[(E)-(5-bromo-2-hydroxyphenyl)methylideneamino]-3-hydroxynaphthalene-2-carboxamide;N-[(E)-(5-chloro-2-hydroxyphenyl)methylideneamino]-3-hydroxynaphthalene-2-carboxamide;N-[(E)-(2,5-dihydroxyphenyl)methylideneamino]-3-hydroxynaphthalene-2-carboxamide;3-hydroxy-N-[(E)-(2-hydroxy-5-nitrophenyl)methylideneamino]naphthalene-2-carboxamide;3-hydroxy-N-[(E)-(2-hydroxyphenyl)methylideneamino]naphthalene-2-carboxamide is O=C(N/N=C/c1cc(Br)ccc1O)c1cc2ccccc2cc1O.O=C(N/N=C/c1cc(Cl)ccc1O)c1cc2ccccc2cc1O.O=C(N/N=C/c1cc(O)ccc1O)c1cc2ccccc2cc1O.O=C(N/N=C/c1cc([N+](=O)[O-])ccc1O)c1cc2ccccc2cc1O.O=C(N/N=C/c1ccccc1O)c1cc2ccccc2cc1O.
What is the InChIKey of N-[(E)-(5-bromo-2-hydroxyphenyl)methylideneamino]-3-hydroxynaphthalene-2-carboxamide;N-[(E)-(5-chloro-2-hydroxyphenyl)methylideneamino]-3-hydroxynaphthalene-2-carboxamide;N-[(E)-(2,5-dihydroxyphenyl)methylideneamino]-3-hydroxynaphthalene-2-carboxamide;3-hydroxy-N-[(E)-(2-hydroxy-5-nitrophenyl)methylideneamino]naphthalene-2-carboxamide;3-hydroxy-N-[(E)-(2-hydroxyphenyl)methylideneamino]naphthalene-2-carboxamide?
The InChIKey is JLUFECTVCFQJDZ-QHVOENNSSA-N. The full InChI is InChI=1S/C18H13BrN2O3.C18H13ClN2O3.C18H13N3O5.C18H14N2O4.C18H14N2O3/c2*19-14-5-6-16(22)13(7-14)10-20-21-18(24)15-8-11-3-1-2-4-12(11)9-17(15)23;22-16-6-5-14(21(25)26)7-13(16)10-19-20-18(24)15-8-11-3-1-2-4-12(11)9-17(15)23;21-14-5-6-16(22)13(7-14)10-19-20-18(24)15-8-11-3-1-2-4-12(11)9-17(15)23;21-16-8-4-3-7-14(16)11-19-20-18(23)15-9-12-5-1-2-6-13(12)10-17(15)22/h2*1-10,22-23H,(H,21,24);1-10,22-23H,(H,20,24);1-10,21-23H,(H,20,24);1-11,21-22H,(H,20,23)/b2*20-10+;2*19-10+;19-11+.
What are the key properties of N-[(E)-(5-bromo-2-hydroxyphenyl)methylideneamino]-3-hydroxynaphthalene-2-carboxamide;N-[(E)-(5-chloro-2-hydroxyphenyl)methylideneamino]-3-hydroxynaphthalene-2-carboxamide;N-[(E)-(2,5-dihydroxyphenyl)methylideneamino]-3-hydroxynaphthalene-2-carboxamide;3-hydroxy-N-[(E)-(2-hydroxy-5-nitrophenyl)methylideneamino]naphthalene-2-carboxamide;3-hydroxy-N-[(E)-(2-hydroxyphenyl)methylideneamino]naphthalene-2-carboxamide?
N-[(E)-(5-bromo-2-hydroxyphenyl)methylideneamino]-3-hydroxynaphthalene-2-carboxamide;N-[(E)-(5-chloro-2-hydroxyphenyl)methylideneamino]-3-hydroxynaphthalene-2-carboxamide;N-[(E)-(2,5-dihydroxyphenyl)methylideneamino]-3-hydroxynaphthalene-2-carboxamide;3-hydroxy-N-[(E)-(2-hydroxy-5-nitrophenyl)methylideneamino]naphthalene-2-carboxamide;3-hydroxy-N-[(E)-(2-hydroxyphenyl)methylideneamino]naphthalene-2-carboxamide has a molecular weight of 1705.94 g/mol, XLogP of 16.10, 16 rotatable bonds, 16 hydrogen bond donors, and 23 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(E)-(5-bromo-2-hydroxyphenyl)methylideneamino]-3-hydroxynaphthalene-2-carboxamide;N-[(E)-(5-chloro-2-hydroxyphenyl)methylideneamino]-3-hydroxynaphthalene-2-carboxamide;N-[(E)-(2,5-dihydroxyphenyl)methylideneamino]-3-hydroxynaphthalene-2-carboxamide;3-hydroxy-N-[(E)-(2-hydroxy-5-nitrophenyl)methylideneamino]naphthalene-2-carboxamide;3-hydroxy-N-[(E)-(2-hydroxyphenyl)methylideneamino]naphthalene-2-carboxamide is sourced from PubChem (CID 172917708), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).