N-[4-(3-chloro-4-methylphenyl)-1,3-thiazol-2-yl]-4-hydroxy-3-methoxybenzamide

C18H15ClN2O3S — CID 162121520

IUPACN-[4-(3-chloro-4-methylphenyl)-1,3-thiazol-2-yl]-4-hydroxy-3-methoxybenzamide
SMILESCOc1cc(C(=O)Nc2nc(-c3ccc(C)c(Cl)c3)cs2)ccc1O
InChIInChI=1S/C18H15ClN2O3S/c1-10-3-4-11(7-13(10)19)14-9-25-18(20-14)21-17(23)12-5-6-15(22)16(8-12)24-2/h3-9,22H,1-2H3,(H,20,21,23)
InChIKeyUDYVJVXCMOIYRY-UHFFFAOYSA-N
MW374.85 g/mol
LogP4.74
Rot. Bonds4

About N-[4-(3-chloro-4-methylphenyl)-1,3-thiazol-2-yl]-4-hydroxy-3-methoxybenzamide

N-[4-(3-chloro-4-methylphenyl)-1,3-thiazol-2-yl]-4-hydroxy-3-methoxybenzamide (PubChem CID 162121520) has the molecular formula C18H15ClN2O3S and a molecular weight of 374.85 g/mol. Its IUPAC name is N-[4-(3-chloro-4-methylphenyl)-1,3-thiazol-2-yl]-4-hydroxy-3-methoxybenzamide.

Molecular Properties

Compound NameN-[4-(3-chloro-4-methylphenyl)-1,3-thiazol-2-yl]-4-hydroxy-3-methoxybenzamide
PubChem CID162121520
Molecular FormulaC18H15ClN2O3S
Molecular Weight374.85 g/mol
Exact Mass374.05
IUPAC NameN-[4-(3-chloro-4-methylphenyl)-1,3-thiazol-2-yl]-4-hydroxy-3-methoxybenzamide
SMILESCOc1cc(C(=O)Nc2nc(-c3ccc(C)c(Cl)c3)cs2)ccc1O
InChIInChI=1S/C18H15ClN2O3S/c1-10-3-4-11(7-13(10)19)14-9-25-18(20-14)21-17(23)12-5-6-15(22)16(8-12)24-2/h3-9,22H,1-2H3,(H,20,21,23)
InChIKeyUDYVJVXCMOIYRY-UHFFFAOYSA-N
XLogP4.74
TPSA71.45 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500374.85
LogP ≤ 54.74
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

2-chloro-N-[4-(3-chloro-4-methoxyphenyl)-1,3-thiazol-2-yl]pyridine-4-carboxamide
CID 32696321
3-chloro-N-[4-(3,4-dimethoxyphenyl)-1,3-thiazol-2-yl]-4-methoxybenzamide
CID 6491053
3-methoxy-4-methyl-N-(4-naphthalen-2-yl-1,3-thiazol-2-yl)benzamide
CID 18229856
N-[4-(4-hydroxy-3-methoxyphenyl)-1,3-thiazol-2-yl]furan-3-carboxamide
CID 88901599
N-[4-(3-chloro-4-methoxyphenyl)-1,3-thiazol-2-yl]-2H-benzotriazole-5-carboxamide
CID 41221106
N-[4-(3,4-difluorophenyl)-1,3-thiazol-2-yl]-3,4-dimethoxybenzamide
CID 7742220
N-[4-(3-chloro-4-methoxyphenyl)-1,3-thiazol-2-yl]-3,5-dimethoxybenzamide
CID 7603429
methyl 6-[[4-(3-chloro-4-methoxyphenyl)-1,3-thiazol-2-yl]carbamoyl]pyridine-3-carboxylate
CID 32520564
N-[4-(3,4-difluorophenyl)-1,3-thiazol-2-yl]-3,4-dimethylbenzamide
CID 16820840
3,5-dichloro-N-[4-(3,4-dimethoxyphenyl)-1,3-thiazol-2-yl]-4-methoxybenzamide
CID 4009017
N-[4-(3,4-dimethylphenyl)-1,3-thiazol-2-yl]-3-methoxybenzamide
CID 734137
N-[4-(3-chloro-4-methoxyphenyl)-1,3-thiazol-2-yl]-6-(trifluoromethyl)pyridine-3-carboxamide
CID 33172817

Frequently Asked Questions

What is the IUPAC name of N-[4-(3-chloro-4-methylphenyl)-1,3-thiazol-2-yl]-4-hydroxy-3-methoxybenzamide?
The IUPAC name of N-[4-(3-chloro-4-methylphenyl)-1,3-thiazol-2-yl]-4-hydroxy-3-methoxybenzamide (CID 162121520) is N-[4-(3-chloro-4-methylphenyl)-1,3-thiazol-2-yl]-4-hydroxy-3-methoxybenzamide.
What is the SMILES notation for N-[4-(3-chloro-4-methylphenyl)-1,3-thiazol-2-yl]-4-hydroxy-3-methoxybenzamide?
The canonical SMILES for N-[4-(3-chloro-4-methylphenyl)-1,3-thiazol-2-yl]-4-hydroxy-3-methoxybenzamide is COc1cc(C(=O)Nc2nc(-c3ccc(C)c(Cl)c3)cs2)ccc1O.
What is the InChIKey of N-[4-(3-chloro-4-methylphenyl)-1,3-thiazol-2-yl]-4-hydroxy-3-methoxybenzamide?
The InChIKey is UDYVJVXCMOIYRY-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H15ClN2O3S/c1-10-3-4-11(7-13(10)19)14-9-25-18(20-14)21-17(23)12-5-6-15(22)16(8-12)24-2/h3-9,22H,1-2H3,(H,20,21,23).
What are the key properties of N-[4-(3-chloro-4-methylphenyl)-1,3-thiazol-2-yl]-4-hydroxy-3-methoxybenzamide?
N-[4-(3-chloro-4-methylphenyl)-1,3-thiazol-2-yl]-4-hydroxy-3-methoxybenzamide has a molecular weight of 374.85 g/mol, XLogP of 4.74, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(3-chloro-4-methylphenyl)-1,3-thiazol-2-yl]-4-hydroxy-3-methoxybenzamide is sourced from PubChem (CID 162121520), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).