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Predict NMR spectrum
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| InChI: |
1S/C27H28Br2O5S/c1-13(2)17-11-20(15(5)23(28)25(17)30)27(19-9-7-8-10-22(19)35(32,33)34-27)21-12-18(14(3)4)26(31)24(29)16(21)6/h7-14,30-31H,1-6H3 |
| InChIKey: |
NUHCTOLBWMJMLX-UHFFFAOYSA-N |
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| H donor: |
2 |
| H acceptor: |
5 |
| Rotatable bond: |
4 |
| Stereocenter: |
0 |
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| cLogP: |
7.013 |
| cLogS: |
-6.178 |
| Polar surface: |
92.21 |
| NEW: 3D model: |
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