N-(4-phenylmethoxyphenyl)-4-(1,3-thiazol-2-yloxy)benzamide

C23H18N2O3S — CID 91813720

IUPACN-(4-phenylmethoxyphenyl)-4-(1,3-thiazol-2-yloxy)benzamide
SMILESO=C(Nc1ccc(OCc2ccccc2)cc1)c1ccc(Oc2nccs2)cc1
InChIInChI=1S/C23H18N2O3S/c26-22(18-6-10-21(11-7-18)28-23-24-14-15-29-23)25-19-8-12-20(13-9-19)27-16-17-4-2-1-3-5-17/h1-15H,16H2,(H,25,26)
InChIKeyMLULYQZTAUDXDL-UHFFFAOYSA-N
MW402.48 g/mol
LogP5.77
Rot. Bonds7

About N-(4-phenylmethoxyphenyl)-4-(1,3-thiazol-2-yloxy)benzamide

N-(4-phenylmethoxyphenyl)-4-(1,3-thiazol-2-yloxy)benzamide (PubChem CID 91813720) has the molecular formula C23H18N2O3S and a molecular weight of 402.48 g/mol. Its IUPAC name is N-(4-phenylmethoxyphenyl)-4-(1,3-thiazol-2-yloxy)benzamide.

Molecular Properties

Compound NameN-(4-phenylmethoxyphenyl)-4-(1,3-thiazol-2-yloxy)benzamide
PubChem CID91813720
Molecular FormulaC23H18N2O3S
Molecular Weight402.48 g/mol
Exact Mass402.10
IUPAC NameN-(4-phenylmethoxyphenyl)-4-(1,3-thiazol-2-yloxy)benzamide
SMILESO=C(Nc1ccc(OCc2ccccc2)cc1)c1ccc(Oc2nccs2)cc1
InChIInChI=1S/C23H18N2O3S/c26-22(18-6-10-21(11-7-18)28-23-24-14-15-29-23)25-19-8-12-20(13-9-19)27-16-17-4-2-1-3-5-17/h1-15H,16H2,(H,25,26)
InChIKeyMLULYQZTAUDXDL-UHFFFAOYSA-N
XLogP5.77
TPSA60.45 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms29
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500402.48
LogP ≤ 55.77
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-[4-(phenoxymethyl)phenyl]benzamide
CID 141092226
4-cyano-N-(4-phenylmethoxyphenyl)benzamide
CID 40610982
N-[4-(2-methylpropoxy)phenyl]-4-phenylmethoxybenzamide
CID 4958406
N-(4-phenylmethoxyphenyl)-1,3-benzoxazole-5-carboxamide
CID 110388232
4-heptoxy-N-(4-phenylmethoxyphenyl)benzamide
CID 4950725
N-(4-ethylphenyl)-4-(phenoxymethyl)benzamide
CID 2195613
N-[4-(4-phenylmethoxyanilino)phenyl]pyridine-3-carboxamide
CID 112988913
4-[(2-methylimidazol-1-yl)methyl]-N-(4-phenylmethoxyphenyl)benzamide
CID 43922241
4-(phenoxymethyl)-N-[4-(trifluoromethoxy)phenyl]benzamide
CID 7957132
4-[(2-chlorophenyl)methoxy]-N-(4-phenoxyphenyl)benzamide
CID 19916426
N-(4-phenylmethoxyphenyl)-6-pyrrolidin-1-ylpyridine-3-carboxamide
CID 109152128
3,5-dimethoxy-N-(4-phenylmethoxyphenyl)benzamide
CID 2791610

Frequently Asked Questions

What is the IUPAC name of N-(4-phenylmethoxyphenyl)-4-(1,3-thiazol-2-yloxy)benzamide?
The IUPAC name of N-(4-phenylmethoxyphenyl)-4-(1,3-thiazol-2-yloxy)benzamide (CID 91813720) is N-(4-phenylmethoxyphenyl)-4-(1,3-thiazol-2-yloxy)benzamide.
What is the SMILES notation for N-(4-phenylmethoxyphenyl)-4-(1,3-thiazol-2-yloxy)benzamide?
The canonical SMILES for N-(4-phenylmethoxyphenyl)-4-(1,3-thiazol-2-yloxy)benzamide is O=C(Nc1ccc(OCc2ccccc2)cc1)c1ccc(Oc2nccs2)cc1.
What is the InChIKey of N-(4-phenylmethoxyphenyl)-4-(1,3-thiazol-2-yloxy)benzamide?
The InChIKey is MLULYQZTAUDXDL-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H18N2O3S/c26-22(18-6-10-21(11-7-18)28-23-24-14-15-29-23)25-19-8-12-20(13-9-19)27-16-17-4-2-1-3-5-17/h1-15H,16H2,(H,25,26).
What are the key properties of N-(4-phenylmethoxyphenyl)-4-(1,3-thiazol-2-yloxy)benzamide?
N-(4-phenylmethoxyphenyl)-4-(1,3-thiazol-2-yloxy)benzamide has a molecular weight of 402.48 g/mol, XLogP of 5.77, 7 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-phenylmethoxyphenyl)-4-(1,3-thiazol-2-yloxy)benzamide is sourced from PubChem (CID 91813720), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).