N-[4-(3-methylimidazo[2,1-b][1,3]thiazol-6-yl)phenyl]pyridine-3-sulfonamide

C17H14N4O2S2 — CID 7151331

IUPACN-[4-(3-methylimidazo[2,1-b][1,3]thiazol-6-yl)phenyl]pyridine-3-sulfonamide
SMILESCc1csc2nc(-c3ccc(NS(=O)(=O)c4cccnc4)cc3)cn12
InChIInChI=1S/C17H14N4O2S2/c1-12-11-24-17-19-16(10-21(12)17)13-4-6-14(7-5-13)20-25(22,23)15-3-2-8-18-9-15/h2-11,20H,1H3
InChIKeyQGJXXJCHJWBHIW-UHFFFAOYSA-N
MW370.46 g/mol
LogP3.57
Rot. Bonds4

About N-[4-(3-methylimidazo[2,1-b][1,3]thiazol-6-yl)phenyl]pyridine-3-sulfonamide

N-[4-(3-methylimidazo[2,1-b][1,3]thiazol-6-yl)phenyl]pyridine-3-sulfonamide (PubChem CID 7151331) has the molecular formula C17H14N4O2S2 and a molecular weight of 370.46 g/mol. Its IUPAC name is N-[4-(3-methylimidazo[2,1-b][1,3]thiazol-6-yl)phenyl]pyridine-3-sulfonamide.

Molecular Properties

Compound NameN-[4-(3-methylimidazo[2,1-b][1,3]thiazol-6-yl)phenyl]pyridine-3-sulfonamide
PubChem CID7151331
Molecular FormulaC17H14N4O2S2
Molecular Weight370.46 g/mol
Exact Mass370.06
IUPAC NameN-[4-(3-methylimidazo[2,1-b][1,3]thiazol-6-yl)phenyl]pyridine-3-sulfonamide
SMILESCc1csc2nc(-c3ccc(NS(=O)(=O)c4cccnc4)cc3)cn12
InChIInChI=1S/C17H14N4O2S2/c1-12-11-24-17-19-16(10-21(12)17)13-4-6-14(7-5-13)20-25(22,23)15-3-2-8-18-9-15/h2-11,20H,1H3
InChIKeyQGJXXJCHJWBHIW-UHFFFAOYSA-N
XLogP3.57
TPSA76.36 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500370.46
LogP ≤ 53.57
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of N-[4-(3-methylimidazo[2,1-b][1,3]thiazol-6-yl)phenyl]pyridine-3-sulfonamide?
The IUPAC name of N-[4-(3-methylimidazo[2,1-b][1,3]thiazol-6-yl)phenyl]pyridine-3-sulfonamide (CID 7151331) is N-[4-(3-methylimidazo[2,1-b][1,3]thiazol-6-yl)phenyl]pyridine-3-sulfonamide.
What is the SMILES notation for N-[4-(3-methylimidazo[2,1-b][1,3]thiazol-6-yl)phenyl]pyridine-3-sulfonamide?
The canonical SMILES for N-[4-(3-methylimidazo[2,1-b][1,3]thiazol-6-yl)phenyl]pyridine-3-sulfonamide is Cc1csc2nc(-c3ccc(NS(=O)(=O)c4cccnc4)cc3)cn12.
What is the InChIKey of N-[4-(3-methylimidazo[2,1-b][1,3]thiazol-6-yl)phenyl]pyridine-3-sulfonamide?
The InChIKey is QGJXXJCHJWBHIW-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H14N4O2S2/c1-12-11-24-17-19-16(10-21(12)17)13-4-6-14(7-5-13)20-25(22,23)15-3-2-8-18-9-15/h2-11,20H,1H3.
What are the key properties of N-[4-(3-methylimidazo[2,1-b][1,3]thiazol-6-yl)phenyl]pyridine-3-sulfonamide?
N-[4-(3-methylimidazo[2,1-b][1,3]thiazol-6-yl)phenyl]pyridine-3-sulfonamide has a molecular weight of 370.46 g/mol, XLogP of 3.57, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(3-methylimidazo[2,1-b][1,3]thiazol-6-yl)phenyl]pyridine-3-sulfonamide is sourced from PubChem (CID 7151331), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).