| Formula |
C22H30N6OS |
| IUPAC Name |
[(2s,4s)-4-[4-(5-methyl-2-phenyl-pyrazol-2-ium-3-ylium-3-yl)piperazin-1-yl]pyrrolidin-2-yl]-thiazolidin-3-yl-methanone |
| Molecular Mass |
426.578 g·mol−1 |
| Heat of Formation |
216.5 ± 16.7 kJ·mol−1 |
| Dipole Moment |
2.67 ± 1.08 D |
| Volume |
518.33 Å 3 |
| Surface Area |
434.65 Å 2 |
| HOMO Energy |
-8.67 ± 0.55 eV |
| LUMO Energy |
-0.60 ± eV |
| Point Group Symmetry |
C1
|
| Synonyms
|
- [(2s,4s)-4-[4-(5-methyl-2-phenyl-3-pyrazolyl)-1-piperazinyl]-2-pyrrolidinyl]-(3-thiazolidinyl)methanone
- [(2s,4s)-4-[4-(5-methyl-2-phenyl-pyrazol-3-yl)piperazin-1-yl]pyrrolidin-2-yl]-(1,3-thiazolidin-3-yl)methanone
- [(2s,4s)-4-[4-(5-methyl-2-phenyl-pyrazol-3-yl)piperazin-1-yl]pyrrolidin-2-yl]-thiazolidin-3-yl-methanone
- [(2s,4s)-4-[4-(5-methyl-2-phenylpyrazol-3-yl)piperazin-1-yl]pyrrolidin-2-yl]-(1,3-thiazolidin-3-yl)methanone
|
| InChIKey |
WGRQANOPCQRCME-PMACEKPBSA-N |
| QR Code |
Generate QR Code |
| Links |
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|
| DOI |
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| Downloads |
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|
| Elements |
H
S
C
O
N
|
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