(NZ)-N-[phenyl-(2-phenylsulfanylphenyl)methylidene]hydroxylamine

C19H15NOS — CID 10756983

IUPAC(NZ)-N-[phenyl-(2-phenylsulfanylphenyl)methylidene]hydroxylamine
SMILESO/N=C(/c1ccccc1)c1ccccc1Sc1ccccc1
InChIInChI=1S/C19H15NOS/c21-20-19(15-9-3-1-4-10-15)17-13-7-8-14-18(17)22-16-11-5-2-6-12-16/h1-14,21H/b20-19-
InChIKeySOLMJWDZPIGXAN-VXPUYCOJSA-N
MW305.40 g/mol
LogP5.06
Rot. Bonds4

About (NZ)-N-[phenyl-(2-phenylsulfanylphenyl)methylidene]hydroxylamine

(NZ)-N-[phenyl-(2-phenylsulfanylphenyl)methylidene]hydroxylamine (PubChem CID 10756983) has the molecular formula C19H15NOS and a molecular weight of 305.40 g/mol. Its IUPAC name is (NZ)-N-[phenyl-(2-phenylsulfanylphenyl)methylidene]hydroxylamine.

Molecular Properties

Compound Name(NZ)-N-[phenyl-(2-phenylsulfanylphenyl)methylidene]hydroxylamine
PubChem CID10756983
Molecular FormulaC19H15NOS
Molecular Weight305.40 g/mol
Exact Mass305.09
IUPAC Name(NZ)-N-[phenyl-(2-phenylsulfanylphenyl)methylidene]hydroxylamine
SMILESO/N=C(/c1ccccc1)c1ccccc1Sc1ccccc1
InChIInChI=1S/C19H15NOS/c21-20-19(15-9-3-1-4-10-15)17-13-7-8-14-18(17)22-16-11-5-2-6-12-16/h1-14,21H/b20-19-
InChIKeySOLMJWDZPIGXAN-VXPUYCOJSA-N
XLogP5.06
TPSA32.59 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500305.40
LogP ≤ 55.06
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of (NZ)-N-[phenyl-(2-phenylsulfanylphenyl)methylidene]hydroxylamine?
The IUPAC name of (NZ)-N-[phenyl-(2-phenylsulfanylphenyl)methylidene]hydroxylamine (CID 10756983) is (NZ)-N-[phenyl-(2-phenylsulfanylphenyl)methylidene]hydroxylamine.
What is the SMILES notation for (NZ)-N-[phenyl-(2-phenylsulfanylphenyl)methylidene]hydroxylamine?
The canonical SMILES for (NZ)-N-[phenyl-(2-phenylsulfanylphenyl)methylidene]hydroxylamine is O/N=C(/c1ccccc1)c1ccccc1Sc1ccccc1.
What is the InChIKey of (NZ)-N-[phenyl-(2-phenylsulfanylphenyl)methylidene]hydroxylamine?
The InChIKey is SOLMJWDZPIGXAN-VXPUYCOJSA-N. The full InChI is InChI=1S/C19H15NOS/c21-20-19(15-9-3-1-4-10-15)17-13-7-8-14-18(17)22-16-11-5-2-6-12-16/h1-14,21H/b20-19-.
What are the key properties of (NZ)-N-[phenyl-(2-phenylsulfanylphenyl)methylidene]hydroxylamine?
(NZ)-N-[phenyl-(2-phenylsulfanylphenyl)methylidene]hydroxylamine has a molecular weight of 305.40 g/mol, XLogP of 5.06, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (NZ)-N-[phenyl-(2-phenylsulfanylphenyl)methylidene]hydroxylamine is sourced from PubChem (CID 10756983), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).