3,5-dichloro-4-methoxy-N-[2-(1,3-thiazol-2-ylcarbamoyl)phenyl]benzamide

C18H13Cl2N3O3S — CID 17361254

IUPAC3,5-dichloro-4-methoxy-N-[2-(1,3-thiazol-2-ylcarbamoyl)phenyl]benzamide
SMILESCOc1c(Cl)cc(C(=O)Nc2ccccc2C(=O)Nc2nccs2)cc1Cl
InChIInChI=1S/C18H13Cl2N3O3S/c1-26-15-12(19)8-10(9-13(15)20)16(24)22-14-5-3-2-4-11(14)17(25)23-18-21-6-7-27-18/h2-9H,1H3,(H,22,24)(H,21,23,25)
InChIKeyNEKMVTMRPQCQIE-UHFFFAOYSA-N
MW422.29 g/mol
LogP4.96
Rot. Bonds5

About 3,5-dichloro-4-methoxy-N-[2-(1,3-thiazol-2-ylcarbamoyl)phenyl]benzamide

3,5-dichloro-4-methoxy-N-[2-(1,3-thiazol-2-ylcarbamoyl)phenyl]benzamide (PubChem CID 17361254) has the molecular formula C18H13Cl2N3O3S and a molecular weight of 422.29 g/mol. Its IUPAC name is 3,5-dichloro-4-methoxy-N-[2-(1,3-thiazol-2-ylcarbamoyl)phenyl]benzamide.

Molecular Properties

Compound Name3,5-dichloro-4-methoxy-N-[2-(1,3-thiazol-2-ylcarbamoyl)phenyl]benzamide
PubChem CID17361254
Molecular FormulaC18H13Cl2N3O3S
Molecular Weight422.29 g/mol
Exact Mass421.01
IUPAC Name3,5-dichloro-4-methoxy-N-[2-(1,3-thiazol-2-ylcarbamoyl)phenyl]benzamide
SMILESCOc1c(Cl)cc(C(=O)Nc2ccccc2C(=O)Nc2nccs2)cc1Cl
InChIInChI=1S/C18H13Cl2N3O3S/c1-26-15-12(19)8-10(9-13(15)20)16(24)22-14-5-3-2-4-11(14)17(25)23-18-21-6-7-27-18/h2-9H,1H3,(H,22,24)(H,21,23,25)
InChIKeyNEKMVTMRPQCQIE-UHFFFAOYSA-N
XLogP4.96
TPSA80.32 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500422.29
LogP ≤ 54.96
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze 3,5-dichloro-4-methoxy-N-[2-(1,3-thiazol-2-ylcarbamoyl)phenyl]benzamide 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

3,5-dimethoxy-N-[2-(1,3-thiazol-2-ylcarbamoyl)phenyl]benzamide
CID 17361080
2-[(2-methoxybenzoyl)amino]-N-(1,3-thiazol-2-yl)benzamide
CID 17361063
2-[(3,5-dichloro-4-methoxybenzoyl)amino]benzoate
CID 7375111
2-(propan-2-ylamino)-N-(1,3-thiazol-2-yl)benzamide
CID 63107522
2-(4-methoxyanilino)-N-(1,3-thiazol-2-yl)benzamide
CID 52612392
4-methyl-3-nitro-N-[2-(1,3-thiazol-2-ylcarbamoyl)phenyl]benzamide
CID 17361103
2-[2-(4-chlorophenoxy)propanoylamino]-N-(1,3-thiazol-2-yl)benzamide
CID 17361278
3,4,5-trimethoxy-N-[2-[(2-methoxyphenyl)carbamoyl]phenyl]benzamide
CID 990875
2-(2-methylpentanoylamino)-N-(1,3-thiazol-2-yl)benzamide
CID 17358961
2-[2-(2-methoxyanilino)-2-oxoethoxy]-N-(1,3-thiazol-2-yl)benzamide
CID 1301072
4-amino-3-chloro-5-methyl-N-(1,3-thiazol-2-yl)benzamide
CID 86046988
2-[(2-methylpropan-2-yl)oxy]-N-(1,3-thiazol-2-yl)benzamide
CID 110464702

Frequently Asked Questions

What is the IUPAC name of 3,5-dichloro-4-methoxy-N-[2-(1,3-thiazol-2-ylcarbamoyl)phenyl]benzamide?
The IUPAC name of 3,5-dichloro-4-methoxy-N-[2-(1,3-thiazol-2-ylcarbamoyl)phenyl]benzamide (CID 17361254) is 3,5-dichloro-4-methoxy-N-[2-(1,3-thiazol-2-ylcarbamoyl)phenyl]benzamide.
What is the SMILES notation for 3,5-dichloro-4-methoxy-N-[2-(1,3-thiazol-2-ylcarbamoyl)phenyl]benzamide?
The canonical SMILES for 3,5-dichloro-4-methoxy-N-[2-(1,3-thiazol-2-ylcarbamoyl)phenyl]benzamide is COc1c(Cl)cc(C(=O)Nc2ccccc2C(=O)Nc2nccs2)cc1Cl.
What is the InChIKey of 3,5-dichloro-4-methoxy-N-[2-(1,3-thiazol-2-ylcarbamoyl)phenyl]benzamide?
The InChIKey is NEKMVTMRPQCQIE-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H13Cl2N3O3S/c1-26-15-12(19)8-10(9-13(15)20)16(24)22-14-5-3-2-4-11(14)17(25)23-18-21-6-7-27-18/h2-9H,1H3,(H,22,24)(H,21,23,25).
What are the key properties of 3,5-dichloro-4-methoxy-N-[2-(1,3-thiazol-2-ylcarbamoyl)phenyl]benzamide?
3,5-dichloro-4-methoxy-N-[2-(1,3-thiazol-2-ylcarbamoyl)phenyl]benzamide has a molecular weight of 422.29 g/mol, XLogP of 4.96, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3,5-dichloro-4-methoxy-N-[2-(1,3-thiazol-2-ylcarbamoyl)phenyl]benzamide is sourced from PubChem (CID 17361254), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).