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

C15H17N3O5S2 — CID 1107091

IUPAC4-methoxy-3-morpholin-4-ylsulfonyl-N-(1,3-thiazol-2-yl)benzamide
SMILESCOc1ccc(C(=O)Nc2nccs2)cc1S(=O)(=O)N1CCOCC1
InChIInChI=1S/C15H17N3O5S2/c1-22-12-3-2-11(14(19)17-15-16-4-9-24-15)10-13(12)25(20,21)18-5-7-23-8-6-18/h2-4,9-10H,5-8H2,1H3,(H,16,17,19)
InChIKeyPZYJOLOKWNHMMT-UHFFFAOYSA-N
MW383.45 g/mol
LogP1.42
Rot. Bonds5

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

4-methoxy-3-morpholin-4-ylsulfonyl-N-(1,3-thiazol-2-yl)benzamide (PubChem CID 1107091) has the molecular formula C15H17N3O5S2 and a molecular weight of 383.45 g/mol. Its IUPAC name is 4-methoxy-3-morpholin-4-ylsulfonyl-N-(1,3-thiazol-2-yl)benzamide.

Molecular Properties

Compound Name4-methoxy-3-morpholin-4-ylsulfonyl-N-(1,3-thiazol-2-yl)benzamide
PubChem CID1107091
Molecular FormulaC15H17N3O5S2
Molecular Weight383.45 g/mol
Exact Mass383.06
IUPAC Name4-methoxy-3-morpholin-4-ylsulfonyl-N-(1,3-thiazol-2-yl)benzamide
SMILESCOc1ccc(C(=O)Nc2nccs2)cc1S(=O)(=O)N1CCOCC1
InChIInChI=1S/C15H17N3O5S2/c1-22-12-3-2-11(14(19)17-15-16-4-9-24-15)10-13(12)25(20,21)18-5-7-23-8-6-18/h2-4,9-10H,5-8H2,1H3,(H,16,17,19)
InChIKeyPZYJOLOKWNHMMT-UHFFFAOYSA-N
XLogP1.42
TPSA97.83 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds5
Heavy Atoms25
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500383.45
LogP ≤ 51.42
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Frequently Asked Questions

What is the IUPAC name of 4-methoxy-3-morpholin-4-ylsulfonyl-N-(1,3-thiazol-2-yl)benzamide?
The IUPAC name of 4-methoxy-3-morpholin-4-ylsulfonyl-N-(1,3-thiazol-2-yl)benzamide (CID 1107091) is 4-methoxy-3-morpholin-4-ylsulfonyl-N-(1,3-thiazol-2-yl)benzamide.
What is the SMILES notation for 4-methoxy-3-morpholin-4-ylsulfonyl-N-(1,3-thiazol-2-yl)benzamide?
The canonical SMILES for 4-methoxy-3-morpholin-4-ylsulfonyl-N-(1,3-thiazol-2-yl)benzamide is COc1ccc(C(=O)Nc2nccs2)cc1S(=O)(=O)N1CCOCC1.
What is the InChIKey of 4-methoxy-3-morpholin-4-ylsulfonyl-N-(1,3-thiazol-2-yl)benzamide?
The InChIKey is PZYJOLOKWNHMMT-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17N3O5S2/c1-22-12-3-2-11(14(19)17-15-16-4-9-24-15)10-13(12)25(20,21)18-5-7-23-8-6-18/h2-4,9-10H,5-8H2,1H3,(H,16,17,19).
What are the key properties of 4-methoxy-3-morpholin-4-ylsulfonyl-N-(1,3-thiazol-2-yl)benzamide?
4-methoxy-3-morpholin-4-ylsulfonyl-N-(1,3-thiazol-2-yl)benzamide has a molecular weight of 383.45 g/mol, XLogP of 1.42, 5 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methoxy-3-morpholin-4-ylsulfonyl-N-(1,3-thiazol-2-yl)benzamide is sourced from PubChem (CID 1107091), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).