3-methoxy-4-(8-methoxyimidazo[1,2-a]pyrazin-2-yl)-N,N-dimethylbenzenesulfonamide

C16H18N4O4S — CID 70047558

IUPAC3-methoxy-4-(8-methoxyimidazo[1,2-a]pyrazin-2-yl)-N,N-dimethylbenzenesulfonamide
SMILESCOc1cc(S(=O)(=O)N(C)C)ccc1-c1cn2ccnc(OC)c2n1
InChIInChI=1S/C16H18N4O4S/c1-19(2)25(21,22)11-5-6-12(14(9-11)23-3)13-10-20-8-7-17-16(24-4)15(20)18-13/h5-10H,1-4H3
InChIKeyMTSCFIHWNMYLCX-UHFFFAOYSA-N
MW362.41 g/mol
LogP1.66
Rot. Bonds5

About 3-methoxy-4-(8-methoxyimidazo[1,2-a]pyrazin-2-yl)-N,N-dimethylbenzenesulfonamide

3-methoxy-4-(8-methoxyimidazo[1,2-a]pyrazin-2-yl)-N,N-dimethylbenzenesulfonamide (PubChem CID 70047558) has the molecular formula C16H18N4O4S and a molecular weight of 362.41 g/mol. Its IUPAC name is 3-methoxy-4-(8-methoxyimidazo[1,2-a]pyrazin-2-yl)-N,N-dimethylbenzenesulfonamide.

Molecular Properties

Compound Name3-methoxy-4-(8-methoxyimidazo[1,2-a]pyrazin-2-yl)-N,N-dimethylbenzenesulfonamide
PubChem CID70047558
Molecular FormulaC16H18N4O4S
Molecular Weight362.41 g/mol
Exact Mass362.10
IUPAC Name3-methoxy-4-(8-methoxyimidazo[1,2-a]pyrazin-2-yl)-N,N-dimethylbenzenesulfonamide
SMILESCOc1cc(S(=O)(=O)N(C)C)ccc1-c1cn2ccnc(OC)c2n1
InChIInChI=1S/C16H18N4O4S/c1-19(2)25(21,22)11-5-6-12(14(9-11)23-3)13-10-20-8-7-17-16(24-4)15(20)18-13/h5-10H,1-4H3
InChIKeyMTSCFIHWNMYLCX-UHFFFAOYSA-N
XLogP1.66
TPSA86.03 Ų
H-Bond Donors
H-Bond Acceptors7
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500362.41
LogP ≤ 51.66
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 107

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Frequently Asked Questions

What is the IUPAC name of 3-methoxy-4-(8-methoxyimidazo[1,2-a]pyrazin-2-yl)-N,N-dimethylbenzenesulfonamide?
The IUPAC name of 3-methoxy-4-(8-methoxyimidazo[1,2-a]pyrazin-2-yl)-N,N-dimethylbenzenesulfonamide (CID 70047558) is 3-methoxy-4-(8-methoxyimidazo[1,2-a]pyrazin-2-yl)-N,N-dimethylbenzenesulfonamide.
What is the SMILES notation for 3-methoxy-4-(8-methoxyimidazo[1,2-a]pyrazin-2-yl)-N,N-dimethylbenzenesulfonamide?
The canonical SMILES for 3-methoxy-4-(8-methoxyimidazo[1,2-a]pyrazin-2-yl)-N,N-dimethylbenzenesulfonamide is COc1cc(S(=O)(=O)N(C)C)ccc1-c1cn2ccnc(OC)c2n1.
What is the InChIKey of 3-methoxy-4-(8-methoxyimidazo[1,2-a]pyrazin-2-yl)-N,N-dimethylbenzenesulfonamide?
The InChIKey is MTSCFIHWNMYLCX-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H18N4O4S/c1-19(2)25(21,22)11-5-6-12(14(9-11)23-3)13-10-20-8-7-17-16(24-4)15(20)18-13/h5-10H,1-4H3.
What are the key properties of 3-methoxy-4-(8-methoxyimidazo[1,2-a]pyrazin-2-yl)-N,N-dimethylbenzenesulfonamide?
3-methoxy-4-(8-methoxyimidazo[1,2-a]pyrazin-2-yl)-N,N-dimethylbenzenesulfonamide has a molecular weight of 362.41 g/mol, XLogP of 1.66, 5 rotatable bonds, 0 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methoxy-4-(8-methoxyimidazo[1,2-a]pyrazin-2-yl)-N,N-dimethylbenzenesulfonamide is sourced from PubChem (CID 70047558), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).