2,6-dichloro-N-[4-(2-chlorophenyl)-1,3-thiazol-2-yl]benzamide

C16H9Cl3N2OS — CID 35523547

IUPAC2,6-dichloro-N-[4-(2-chlorophenyl)-1,3-thiazol-2-yl]benzamide
SMILESO=C(Nc1nc(-c2ccccc2Cl)cs1)c1c(Cl)cccc1Cl
InChIInChI=1S/C16H9Cl3N2OS/c17-10-5-2-1-4-9(10)13-8-23-16(20-13)21-15(22)14-11(18)6-3-7-12(14)19/h1-8H,(H,20,21,22)
InChIKeySALOXINQFLGUGI-UHFFFAOYSA-N
MW383.69 g/mol
LogP6.02
Rot. Bonds3

About 2,6-dichloro-N-[4-(2-chlorophenyl)-1,3-thiazol-2-yl]benzamide

2,6-dichloro-N-[4-(2-chlorophenyl)-1,3-thiazol-2-yl]benzamide (PubChem CID 35523547) has the molecular formula C16H9Cl3N2OS and a molecular weight of 383.69 g/mol. Its IUPAC name is 2,6-dichloro-N-[4-(2-chlorophenyl)-1,3-thiazol-2-yl]benzamide.

Molecular Properties

Compound Name2,6-dichloro-N-[4-(2-chlorophenyl)-1,3-thiazol-2-yl]benzamide
PubChem CID35523547
Molecular FormulaC16H9Cl3N2OS
Molecular Weight383.69 g/mol
Exact Mass381.95
IUPAC Name2,6-dichloro-N-[4-(2-chlorophenyl)-1,3-thiazol-2-yl]benzamide
SMILESO=C(Nc1nc(-c2ccccc2Cl)cs1)c1c(Cl)cccc1Cl
InChIInChI=1S/C16H9Cl3N2OS/c17-10-5-2-1-4-9(10)13-8-23-16(20-13)21-15(22)14-11(18)6-3-7-12(14)19/h1-8H,(H,20,21,22)
InChIKeySALOXINQFLGUGI-UHFFFAOYSA-N
XLogP6.02
TPSA41.99 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500383.69
LogP ≤ 56.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

4-chloro-N-[4-(2-chlorophenyl)-1,3-thiazol-2-yl]benzamide
CID 19194946
2,6-dichloro-N-[4-(2,4-dimethylphenyl)-1,3-thiazol-2-yl]benzamide
CID 4517277
N-[4-(2-chlorophenyl)-1,3-thiazol-2-yl]furan-3-carboxamide
CID 18102049
N-[4-(2-chlorophenyl)-1,3-thiazol-2-yl]-4-(1,3-dioxoisoindol-2-yl)benzamide
CID 19197399
N-[4-(2-chlorophenyl)-1,3-thiazol-2-yl]-5-methyl-3-phenyl-1,2-oxazole-4-carboxamide
CID 2127353
N-[4-(2-chlorophenyl)-1,3-thiazol-2-yl]-3-methoxybenzamide
CID 7213251
N-[4-(2-chlorophenyl)-1,3-thiazol-2-yl]-2,2,3,3-tetramethylcyclopropane-1-carboxamide
CID 23860914
N-[4-(2-chlorophenyl)-1,3-thiazol-2-yl]-3,5-dimethoxybenzamide
CID 19195203
(Z)-4-[[4-(2-chlorophenyl)-1,3-thiazol-2-yl]amino]-4-oxobut-2-enoic acid
CID 46235790
N-[2-[[4-(2-chlorophenyl)-1,3-thiazol-2-yl]amino]-2-oxoethyl]-2-phenylacetamide
CID 78803762
N-[4-(2-chlorophenyl)-1,3-thiazol-2-yl]-4-methyl-6-methylsulfanyl-2-propan-2-ylpyrimidine-5-carboxamide
CID 78847672
N-[4-(2-chlorophenyl)-1,3-thiazol-2-yl]-3-phenylpropanamide
CID 19194885

Frequently Asked Questions

What is the IUPAC name of 2,6-dichloro-N-[4-(2-chlorophenyl)-1,3-thiazol-2-yl]benzamide?
The IUPAC name of 2,6-dichloro-N-[4-(2-chlorophenyl)-1,3-thiazol-2-yl]benzamide (CID 35523547) is 2,6-dichloro-N-[4-(2-chlorophenyl)-1,3-thiazol-2-yl]benzamide.
What is the SMILES notation for 2,6-dichloro-N-[4-(2-chlorophenyl)-1,3-thiazol-2-yl]benzamide?
The canonical SMILES for 2,6-dichloro-N-[4-(2-chlorophenyl)-1,3-thiazol-2-yl]benzamide is O=C(Nc1nc(-c2ccccc2Cl)cs1)c1c(Cl)cccc1Cl.
What is the InChIKey of 2,6-dichloro-N-[4-(2-chlorophenyl)-1,3-thiazol-2-yl]benzamide?
The InChIKey is SALOXINQFLGUGI-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H9Cl3N2OS/c17-10-5-2-1-4-9(10)13-8-23-16(20-13)21-15(22)14-11(18)6-3-7-12(14)19/h1-8H,(H,20,21,22).
What are the key properties of 2,6-dichloro-N-[4-(2-chlorophenyl)-1,3-thiazol-2-yl]benzamide?
2,6-dichloro-N-[4-(2-chlorophenyl)-1,3-thiazol-2-yl]benzamide has a molecular weight of 383.69 g/mol, XLogP of 6.02, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2,6-dichloro-N-[4-(2-chlorophenyl)-1,3-thiazol-2-yl]benzamide is sourced from PubChem (CID 35523547), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).