4-chloro-N-[(5-chloro-2-pyridinyl)sulfonyl]-3-methoxybenzamide

C13H10Cl2N2O4S — CID 146123111

IUPAC4-chloro-N-[(5-chloro-2-pyridinyl)sulfonyl]-3-methoxybenzamide
SMILESCOc1cc(C(=O)NS(=O)(=O)c2ccc(Cl)cn2)ccc1Cl
InChIInChI=1S/C13H10Cl2N2O4S/c1-21-11-6-8(2-4-10(11)15)13(18)17-22(19,20)12-5-3-9(14)7-16-12/h2-7H,1H3,(H,17,18)
InChIKeyORRCWYOYBOUEHR-UHFFFAOYSA-N
MW361.21 g/mol
LogP2.52
Rot. Bonds4

About 4-chloro-N-[(5-chloro-2-pyridinyl)sulfonyl]-3-methoxybenzamide

4-chloro-N-[(5-chloro-2-pyridinyl)sulfonyl]-3-methoxybenzamide (PubChem CID 146123111) has the molecular formula C13H10Cl2N2O4S and a molecular weight of 361.21 g/mol. Its IUPAC name is 4-chloro-N-[(5-chloro-2-pyridinyl)sulfonyl]-3-methoxybenzamide.

Molecular Properties

Compound Name4-chloro-N-[(5-chloro-2-pyridinyl)sulfonyl]-3-methoxybenzamide
PubChem CID146123111
Molecular FormulaC13H10Cl2N2O4S
Molecular Weight361.21 g/mol
Exact Mass359.97
IUPAC Name4-chloro-N-[(5-chloro-2-pyridinyl)sulfonyl]-3-methoxybenzamide
SMILESCOc1cc(C(=O)NS(=O)(=O)c2ccc(Cl)cn2)ccc1Cl
InChIInChI=1S/C13H10Cl2N2O4S/c1-21-11-6-8(2-4-10(11)15)13(18)17-22(19,20)12-5-3-9(14)7-16-12/h2-7H,1H3,(H,17,18)
InChIKeyORRCWYOYBOUEHR-UHFFFAOYSA-N
XLogP2.52
TPSA85.36 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500361.21
LogP ≤ 52.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 4-chloro-N-[(5-chloro-2-pyridinyl)sulfonyl]-3-methoxybenzamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 4-chloro-N-[(5-chloro-2-pyridinyl)sulfonyl]-3-methoxybenzamide?
The IUPAC name of 4-chloro-N-[(5-chloro-2-pyridinyl)sulfonyl]-3-methoxybenzamide (CID 146123111) is 4-chloro-N-[(5-chloro-2-pyridinyl)sulfonyl]-3-methoxybenzamide.
What is the SMILES notation for 4-chloro-N-[(5-chloro-2-pyridinyl)sulfonyl]-3-methoxybenzamide?
The canonical SMILES for 4-chloro-N-[(5-chloro-2-pyridinyl)sulfonyl]-3-methoxybenzamide is COc1cc(C(=O)NS(=O)(=O)c2ccc(Cl)cn2)ccc1Cl.
What is the InChIKey of 4-chloro-N-[(5-chloro-2-pyridinyl)sulfonyl]-3-methoxybenzamide?
The InChIKey is ORRCWYOYBOUEHR-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H10Cl2N2O4S/c1-21-11-6-8(2-4-10(11)15)13(18)17-22(19,20)12-5-3-9(14)7-16-12/h2-7H,1H3,(H,17,18).
What are the key properties of 4-chloro-N-[(5-chloro-2-pyridinyl)sulfonyl]-3-methoxybenzamide?
4-chloro-N-[(5-chloro-2-pyridinyl)sulfonyl]-3-methoxybenzamide has a molecular weight of 361.21 g/mol, XLogP of 2.52, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-chloro-N-[(5-chloro-2-pyridinyl)sulfonyl]-3-methoxybenzamide is sourced from PubChem (CID 146123111), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).