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Predict NMR spectrum
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| InChI: |
1S/C14H21N3O2S.C4H6O4/c1-15-20(18,19)10-11-4-5-14-13(8-11)12(9-16-14)6-7-17(2)3;5-3(6)1-2-4(7)8/h4-5,8-9,15-16H,6-7,10H2,1-3H3;1-2H2,(H,5,6)(H,7,8) |
| InChIKey: |
PORMUFZNYQJOEI-UHFFFAOYSA-N |
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| H donor: |
4 |
| H acceptor: |
9 |
| Rotatable bond: |
8 |
| Stereocenter: |
0 |
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| cLogP: |
0.076 |
| cLogS: |
-2.599 |
| Polar surface: |
148.18 |
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