(3-Methoxy-4-oxazol-5-yl-phenyl)-(4-phenyl-4,5,6,7-tetrahydro-benzothiazol-2-yl)-amine

HCID 57780726
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Basic information

Standard SMILES
COc1cc(Nc2nc3c(s2)CCCC3c2ccccc2)ccc1-c1cnco1
InChIKey
CVLIAWPTBWHSBQ-UHFFFAOYSA-N
Molecular formula
C23H21N3O2S
Average molar mass
403.5 g/mol
Monoisotopic mass
403.13544809

Names & identifiers

Preferred name
(3-Methoxy-4-oxazol-5-yl-phenyl)-(4-phenyl-4,5,6,7-tetrahydro-benzothiazol-2-yl)-amine
IUPAC
N-[3-methoxy-4-(1,3-oxazol-5-yl)phenyl]-4-phenyl-4,5,6,7-tetrahydro-1,3-benzothiazol-2-amine

Names & synonyms

SCHEMBL1616814CVLIAWPTBWHSBQ-UHFFFAOYSA-N(3-Methoxy-4-oxazol-5-yl-phenyl)-(4-phenyl-4,5,6,7-tetrahydro-benzothiazol-2-yl)-amine

Database identifiers

PubChem CID
57780726

Properties

Computed structural properties

XLogP
5.4
Topological polar surface area
88.4 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
6
Rotatable bonds
5
Heavy atoms
29

Related reactions

1 records
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Compound notes

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