4-(2,5-dichlorophenyl)sulfonyl-2-(5-methyl-1,3,4-oxadiazol-2-yl)morpholine

Name: 4-(2,5-dichlorophenyl)sulfonyl-2-(5-methyl-1,3,4-oxadiazol-2-yl)morpholine — Molecular Data
Creator: MolForge
License: https://creativecommons.org/publicdomain/zero/1.0/

C₁₃H₁₃Cl₂N₃O₄S — CID 129004129

Data last refreshed: 2026-04-15 (MolForge compound catalog, from PubChem)

IUPAC4-(2,5-dichlorophenyl)sulfonyl-2-(5-methyl-1,3,4-oxadiazol-2-yl)morpholine

SMILESCc1nnc(C2CN(S(=O)(=O)c3cc(Cl)ccc3Cl)CCO2)o1

InChIInChI=1S/C13H13Cl2N3O4S/c1-8-16-17-13(22-8)11-7-18(4-5-21-11)23(19,20)12-6-9(14)2-3-10(12)15/h2-3,6,11H,4-5,7H2,1H3

InChIKeyDGWFZAXDWYVVGQ-UHFFFAOYSA-N

MW378.24 g/mol

LogP2.45

Rot. Bonds3

About 4-(2,5-dichlorophenyl)sulfonyl-2-(5-methyl-1,3,4-oxadiazol-2-yl)morpholine

4-(2,5-dichlorophenyl)sulfonyl-2-(5-methyl-1,3,4-oxadiazol-2-yl)morpholine (PubChem CID 129004129) has the molecular formula C₁₃H₁₃Cl₂N₃O₄S and a molecular weight of 378.24 g/mol. Its IUPAC name is 4-(2,5-dichlorophenyl)sulfonyl-2-(5-methyl-1,3,4-oxadiazol-2-yl)morpholine.

Molecular Properties

Compound Name	4-(2,5-dichlorophenyl)sulfonyl-2-(5-methyl-1,3,4-oxadiazol-2-yl)morpholine
PubChem CID	129004129
Molecular Formula	C₁₃H₁₃Cl₂N₃O₄S
Molecular Weight	378.24 g/mol
Exact Mass	377.00
IUPAC Name	4-(2,5-dichlorophenyl)sulfonyl-2-(5-methyl-1,3,4-oxadiazol-2-yl)morpholine
SMILES	Cc1nnc(C2CN(S(=O)(=O)c3cc(Cl)ccc3Cl)CCO2)o1
InChI	InChI=1S/C13H13Cl2N3O4S/c1-8-16-17-13(22-8)11-7-18(4-5-21-11)23(19,20)12-6-9(14)2-3-10(12)15/h2-3,6,11H,4-5,7H2,1H3
InChIKey	DGWFZAXDWYVVGQ-UHFFFAOYSA-N
XLogP	2.45
TPSA	85.53 Å²
H-Bond Donors
H-Bond Acceptors	6
Rotatable Bonds	3
Heavy Atoms	23
Complexity	—

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	378.24
LogP ≤ 5	2.45
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	6

Frequently Asked Questions

What is the IUPAC name of 4-(2,5-dichlorophenyl)sulfonyl-2-(5-methyl-1,3,4-oxadiazol-2-yl)morpholine?

The IUPAC name of 4-(2,5-dichlorophenyl)sulfonyl-2-(5-methyl-1,3,4-oxadiazol-2-yl)morpholine (CID 129004129) is 4-(2,5-dichlorophenyl)sulfonyl-2-(5-methyl-1,3,4-oxadiazol-2-yl)morpholine.

What is the SMILES notation for 4-(2,5-dichlorophenyl)sulfonyl-2-(5-methyl-1,3,4-oxadiazol-2-yl)morpholine?

The canonical SMILES for 4-(2,5-dichlorophenyl)sulfonyl-2-(5-methyl-1,3,4-oxadiazol-2-yl)morpholine is Cc1nnc(C2CN(S(=O)(=O)c3cc(Cl)ccc3Cl)CCO2)o1.

What is the InChIKey of 4-(2,5-dichlorophenyl)sulfonyl-2-(5-methyl-1,3,4-oxadiazol-2-yl)morpholine?

The InChIKey is DGWFZAXDWYVVGQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H13Cl2N3O4S/c1-8-16-17-13(22-8)11-7-18(4-5-21-11)23(19,20)12-6-9(14)2-3-10(12)15/h2-3,6,11H,4-5,7H2,1H3.

What are the key properties of 4-(2,5-dichlorophenyl)sulfonyl-2-(5-methyl-1,3,4-oxadiazol-2-yl)morpholine?

4-(2,5-dichlorophenyl)sulfonyl-2-(5-methyl-1,3,4-oxadiazol-2-yl)morpholine has a molecular weight of 378.24 g/mol, XLogP of 2.45, 3 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.

Where does this data come from?

All data for 4-(2,5-dichlorophenyl)sulfonyl-2-(5-methyl-1,3,4-oxadiazol-2-yl)morpholine is sourced from PubChem (CID 129004129), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).

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Sources

PubChem CID 129004129 — identifiers, structure, computed properties (public domain)

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