N-(7-bromo-6-methyl-[1,3]thiazolo[4,5-c]pyridin-2-yl)benzamide

C14H10BrN3OS — CID 142524471

IUPACN-(7-bromo-6-methyl-[1,3]thiazolo[4,5-c]pyridin-2-yl)benzamide
SMILESCc1ncc2nc(NC(=O)c3ccccc3)sc2c1Br
InChIInChI=1S/C14H10BrN3OS/c1-8-11(15)12-10(7-16-8)17-14(20-12)18-13(19)9-5-3-2-4-6-9/h2-7H,1H3,(H,17,18,19)
InChIKeyLHMSWOXWHAPVCF-UHFFFAOYSA-N
MW348.23 g/mol
LogP4.01
Rot. Bonds2

About N-(7-bromo-6-methyl-[1,3]thiazolo[4,5-c]pyridin-2-yl)benzamide

N-(7-bromo-6-methyl-[1,3]thiazolo[4,5-c]pyridin-2-yl)benzamide (PubChem CID 142524471) has the molecular formula C14H10BrN3OS and a molecular weight of 348.23 g/mol. Its IUPAC name is N-(7-bromo-6-methyl-[1,3]thiazolo[4,5-c]pyridin-2-yl)benzamide.

Molecular Properties

Compound NameN-(7-bromo-6-methyl-[1,3]thiazolo[4,5-c]pyridin-2-yl)benzamide
PubChem CID142524471
Molecular FormulaC14H10BrN3OS
Molecular Weight348.23 g/mol
Exact Mass346.97
IUPAC NameN-(7-bromo-6-methyl-[1,3]thiazolo[4,5-c]pyridin-2-yl)benzamide
SMILESCc1ncc2nc(NC(=O)c3ccccc3)sc2c1Br
InChIInChI=1S/C14H10BrN3OS/c1-8-11(15)12-10(7-16-8)17-14(20-12)18-13(19)9-5-3-2-4-6-9/h2-7H,1H3,(H,17,18,19)
InChIKeyLHMSWOXWHAPVCF-UHFFFAOYSA-N
XLogP4.01
TPSA54.88 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500348.23
LogP ≤ 54.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-(6,7-dimethyl-[1,3]thiazolo[4,5-c]pyridin-2-yl)benzamide;ethane
CID 154659407
N-(7-bromo-6-chloro-[1,3]thiazolo[4,5-c]pyridin-2-yl)benzamide
CID 171486825
N-(5-benzoyl-4-methyl-1,3-thiazol-2-yl)benzamide
CID 7315330
2-benzamido-1,3-benzothiazole-6-carboxylic acid
CID 19622650
2-(2-benzamido-4-methyl-1,3-thiazol-5-yl)acetic acid
CID 82058764
N-(4-bromo-1,3-benzothiazol-2-yl)benzamide
CID 7202695
N-(5,6-difluoro-1,3-benzothiazol-2-yl)benzamide
CID 142741981
N-(7-methyl-4-nitro-1,3-benzothiazol-2-yl)benzamide
CID 22015740
N-(7-nitro-1,3-benzothiazol-2-yl)benzamide
CID 13481964
N-(4,6-dimethyl-1,3-benzothiazol-2-yl)benzamide
CID 4307053
3-(2-benzamido-4-methyl-1,3-thiazol-5-yl)propanoic acid
CID 82058794
N-(6-ethoxy-1,3-benzothiazol-2-yl)-4-(2-oxo-2-phenylacetyl)benzamide
CID 19209994

Frequently Asked Questions

What is the IUPAC name of N-(7-bromo-6-methyl-[1,3]thiazolo[4,5-c]pyridin-2-yl)benzamide?
The IUPAC name of N-(7-bromo-6-methyl-[1,3]thiazolo[4,5-c]pyridin-2-yl)benzamide (CID 142524471) is N-(7-bromo-6-methyl-[1,3]thiazolo[4,5-c]pyridin-2-yl)benzamide.
What is the SMILES notation for N-(7-bromo-6-methyl-[1,3]thiazolo[4,5-c]pyridin-2-yl)benzamide?
The canonical SMILES for N-(7-bromo-6-methyl-[1,3]thiazolo[4,5-c]pyridin-2-yl)benzamide is Cc1ncc2nc(NC(=O)c3ccccc3)sc2c1Br.
What is the InChIKey of N-(7-bromo-6-methyl-[1,3]thiazolo[4,5-c]pyridin-2-yl)benzamide?
The InChIKey is LHMSWOXWHAPVCF-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H10BrN3OS/c1-8-11(15)12-10(7-16-8)17-14(20-12)18-13(19)9-5-3-2-4-6-9/h2-7H,1H3,(H,17,18,19).
What are the key properties of N-(7-bromo-6-methyl-[1,3]thiazolo[4,5-c]pyridin-2-yl)benzamide?
N-(7-bromo-6-methyl-[1,3]thiazolo[4,5-c]pyridin-2-yl)benzamide has a molecular weight of 348.23 g/mol, XLogP of 4.01, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(7-bromo-6-methyl-[1,3]thiazolo[4,5-c]pyridin-2-yl)benzamide is sourced from PubChem (CID 142524471), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).