4-phenyl-5-[(4-phenyl-1,3-thiazol-2-yl)diazenyl]-1,3-thiazol-2-amine

C18H13N5S2 — CID 555382

IUPAC4-phenyl-5-[(4-phenyl-1,3-thiazol-2-yl)diazenyl]-1,3-thiazol-2-amine
SMILESNc1nc(-c2ccccc2)c(N=Nc2nc(-c3ccccc3)cs2)s1
InChIInChI=1S/C18H13N5S2/c19-17-21-15(13-9-5-2-6-10-13)16(25-17)22-23-18-20-14(11-24-18)12-7-3-1-4-8-12/h1-11H,(H2,19,21)
InChIKeySZFKCRIXDKUVBD-UHFFFAOYSA-N
MW363.47 g/mol
LogP5.93
Rot. Bonds4

About 4-phenyl-5-[(4-phenyl-1,3-thiazol-2-yl)diazenyl]-1,3-thiazol-2-amine

4-phenyl-5-[(4-phenyl-1,3-thiazol-2-yl)diazenyl]-1,3-thiazol-2-amine (PubChem CID 555382) has the molecular formula C18H13N5S2 and a molecular weight of 363.47 g/mol. Its IUPAC name is 4-phenyl-5-[(4-phenyl-1,3-thiazol-2-yl)diazenyl]-1,3-thiazol-2-amine.

Molecular Properties

Compound Name4-phenyl-5-[(4-phenyl-1,3-thiazol-2-yl)diazenyl]-1,3-thiazol-2-amine
PubChem CID555382
Molecular FormulaC18H13N5S2
Molecular Weight363.47 g/mol
Exact Mass363.06
IUPAC Name4-phenyl-5-[(4-phenyl-1,3-thiazol-2-yl)diazenyl]-1,3-thiazol-2-amine
SMILESNc1nc(-c2ccccc2)c(N=Nc2nc(-c3ccccc3)cs2)s1
InChIInChI=1S/C18H13N5S2/c19-17-21-15(13-9-5-2-6-10-13)16(25-17)22-23-18-20-14(11-24-18)12-7-3-1-4-8-12/h1-11H,(H2,19,21)
InChIKeySZFKCRIXDKUVBD-UHFFFAOYSA-N
XLogP5.93
TPSA76.52 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500363.47
LogP ≤ 55.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'azo_A(324)', 'substructure': 'N/A'}, {'alert_name': 'diazo_group', 'substructure': 'N/A'}

Analyze 4-phenyl-5-[(4-phenyl-1,3-thiazol-2-yl)diazenyl]-1,3-thiazol-2-amine 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

5-[(2-fluorophenyl)diazenyl]-4-phenyl-1,3-thiazol-2-amine
CID 135672336
5-[(3-fluorophenyl)diazenyl]-4-phenyl-1,3-thiazol-2-amine
CID 135672337
5-[(3-bromophenyl)diazenyl]-4-phenyl-1,3-thiazol-2-amine
CID 4194807
ethane;4-phenyl-1,3-thiazol-2-amine
CID 91233366
4-(4-phenylphenyl)-1,3-thiazole-2,5-diamine
CID 82342174
(2-methyl-1H-indol-3-yl)-(4-phenyl-1,3-thiazol-2-yl)diazene
CID 137234432
diethyl 5-[(Z)-(2-amino-4-phenyl-1,3-thiazol-5-yl)diazenyl]-3-methylthiophene-2,4-dicarboxylate
CID 137269367
(E)-N-(4-phenyl-1,3-thiazol-2-yl)butan-1-imine
CID 119086097
(2-amino-4-phenyl-1,3-thiazol-5-yl) thiocyanate
CID 687958
3-(hydroperoxymethyl)-N,N-dimethyl-4-[(4-phenyl-1,3-thiazol-2-yl)diazenyl]aniline
CID 20581978
benzyl-[4-(4-bromophenyl)-1,3-thiazol-2-yl]diazene
CID 91928514
nickel(2+);bis(2-[(E)-(4-phenyl-1,3-thiazol-2-yl)iminomethyl]phenolate)
CID 170905301

Frequently Asked Questions

What is the IUPAC name of 4-phenyl-5-[(4-phenyl-1,3-thiazol-2-yl)diazenyl]-1,3-thiazol-2-amine?
The IUPAC name of 4-phenyl-5-[(4-phenyl-1,3-thiazol-2-yl)diazenyl]-1,3-thiazol-2-amine (CID 555382) is 4-phenyl-5-[(4-phenyl-1,3-thiazol-2-yl)diazenyl]-1,3-thiazol-2-amine.
What is the SMILES notation for 4-phenyl-5-[(4-phenyl-1,3-thiazol-2-yl)diazenyl]-1,3-thiazol-2-amine?
The canonical SMILES for 4-phenyl-5-[(4-phenyl-1,3-thiazol-2-yl)diazenyl]-1,3-thiazol-2-amine is Nc1nc(-c2ccccc2)c(N=Nc2nc(-c3ccccc3)cs2)s1.
What is the InChIKey of 4-phenyl-5-[(4-phenyl-1,3-thiazol-2-yl)diazenyl]-1,3-thiazol-2-amine?
The InChIKey is SZFKCRIXDKUVBD-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H13N5S2/c19-17-21-15(13-9-5-2-6-10-13)16(25-17)22-23-18-20-14(11-24-18)12-7-3-1-4-8-12/h1-11H,(H2,19,21).
What are the key properties of 4-phenyl-5-[(4-phenyl-1,3-thiazol-2-yl)diazenyl]-1,3-thiazol-2-amine?
4-phenyl-5-[(4-phenyl-1,3-thiazol-2-yl)diazenyl]-1,3-thiazol-2-amine has a molecular weight of 363.47 g/mol, XLogP of 5.93, 4 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 4-phenyl-5-[(4-phenyl-1,3-thiazol-2-yl)diazenyl]-1,3-thiazol-2-amine is sourced from PubChem (CID 555382), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).