3-morpholin-4-ylsulfonyl-N-(1,3-thiazol-2-yl)benzamide

C14H15N3O4S2 — CID 1102157

IUPAC3-morpholin-4-ylsulfonyl-N-(1,3-thiazol-2-yl)benzamide
SMILESO=C(Nc1nccs1)c1cccc(S(=O)(=O)N2CCOCC2)c1
InChIInChI=1S/C14H15N3O4S2/c18-13(16-14-15-4-9-22-14)11-2-1-3-12(10-11)23(19,20)17-5-7-21-8-6-17/h1-4,9-10H,5-8H2,(H,15,16,18)
InChIKeyMWSYFTBXCPPZMT-UHFFFAOYSA-N
MW353.43 g/mol
LogP1.42
Rot. Bonds4

About 3-morpholin-4-ylsulfonyl-N-(1,3-thiazol-2-yl)benzamide

3-morpholin-4-ylsulfonyl-N-(1,3-thiazol-2-yl)benzamide (PubChem CID 1102157) has the molecular formula C14H15N3O4S2 and a molecular weight of 353.43 g/mol. Its IUPAC name is 3-morpholin-4-ylsulfonyl-N-(1,3-thiazol-2-yl)benzamide.

Molecular Properties

Compound Name3-morpholin-4-ylsulfonyl-N-(1,3-thiazol-2-yl)benzamide
PubChem CID1102157
Molecular FormulaC14H15N3O4S2
Molecular Weight353.43 g/mol
Exact Mass353.05
IUPAC Name3-morpholin-4-ylsulfonyl-N-(1,3-thiazol-2-yl)benzamide
SMILESO=C(Nc1nccs1)c1cccc(S(=O)(=O)N2CCOCC2)c1
InChIInChI=1S/C14H15N3O4S2/c18-13(16-14-15-4-9-22-14)11-2-1-3-12(10-11)23(19,20)17-5-7-21-8-6-17/h1-4,9-10H,5-8H2,(H,15,16,18)
InChIKeyMWSYFTBXCPPZMT-UHFFFAOYSA-N
XLogP1.42
TPSA88.60 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500353.43
LogP ≤ 51.42
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

N-2-Thiazolylbenzamide
CID 569547
2-chloro-5-(morpholin-4-ylsulfonyl)-N-(1,3-thiazol-2-yl)benzamide
CID 1102161
3-morpholin-4-ylsulfonyl-N-(4-pyridin-2-yl-1,3-thiazol-2-yl)benzamide
CID 4853713
2-(4-(methylsulfonyl)phenyl)-3-(tetrahydro-2H-pyran-4-yl)-N-(thiazol-2-yl)acrylamide
CID 10385853
4-(Cyclohexylmethyl-sulfamoyl)-N-thiazol-2-yl-benzamide
CID 652627
4-(phenylsulfonyl)-N-1,3-thiazol-2-ylbenzamide
CID 753886
3-(1-piperidinylsulfonyl)-N-(2-thiazolyl)benzamide
CID 1101752
4-(piperidin-1-ylsulfonyl)-N-(thiazol-2-yl)benzamide
CID 1158565
4-fluoro-3-morpholin-4-ylsulfonyl-N-[4-(1,3-thiazol-2-ylsulfamoyl)phenyl]benzamide
CID 2093058
2-(methylsulfanyl)-N-(1,3-thiazol-2-yl)benzamide
CID 2115773
3-[methyl(phenyl)sulfamoyl]-N-(1,3-thiazol-2-yl)benzamide
CID 2115997
4-(4-morpholinylsulfonyl)-N-{4-[(1,3-thiazol-2-ylamino)sulfonyl]phenyl}benzamide
CID 2130259

Frequently Asked Questions

What is the IUPAC name of 3-morpholin-4-ylsulfonyl-N-(1,3-thiazol-2-yl)benzamide?
The IUPAC name of 3-morpholin-4-ylsulfonyl-N-(1,3-thiazol-2-yl)benzamide (CID 1102157) is 3-morpholin-4-ylsulfonyl-N-(1,3-thiazol-2-yl)benzamide.
What is the SMILES notation for 3-morpholin-4-ylsulfonyl-N-(1,3-thiazol-2-yl)benzamide?
The canonical SMILES for 3-morpholin-4-ylsulfonyl-N-(1,3-thiazol-2-yl)benzamide is O=C(Nc1nccs1)c1cccc(S(=O)(=O)N2CCOCC2)c1.
What is the InChIKey of 3-morpholin-4-ylsulfonyl-N-(1,3-thiazol-2-yl)benzamide?
The InChIKey is MWSYFTBXCPPZMT-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15N3O4S2/c18-13(16-14-15-4-9-22-14)11-2-1-3-12(10-11)23(19,20)17-5-7-21-8-6-17/h1-4,9-10H,5-8H2,(H,15,16,18).
What are the key properties of 3-morpholin-4-ylsulfonyl-N-(1,3-thiazol-2-yl)benzamide?
3-morpholin-4-ylsulfonyl-N-(1,3-thiazol-2-yl)benzamide has a molecular weight of 353.43 g/mol, XLogP of 1.42, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 3-morpholin-4-ylsulfonyl-N-(1,3-thiazol-2-yl)benzamide is sourced from PubChem (CID 1102157), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).