| Formula |
C28H31N5O6 |
| IUPAC Name |
2-[2-[[4-(diaminomethyl)phenyl]carbamoyl]-6-methoxy-3-pyridyl]-5-[[(1s)-1-formyl-2,2-dimethyl-propyl]carbamoyl]benzoic acid |
| Molecular Mass |
533.576 g·mol−1 |
| Heat of Formation |
-807.1 ± 16.7 kJ·mol−1 |
| Dipole Moment |
3.62 ± 1.08 D |
| Volume |
644.26 Å 3 |
| Surface Area |
485.36 Å 2 |
| HOMO Energy |
-8.68 ± 0.55 eV |
| LUMO Energy |
-0.98 ± eV |
| Point Group Symmetry |
C1
|
| Synonyms
|
- 2-[2-({[4-(diaminomethyl)phenyl]amino}carbonyl)-6-methoxypyridin-3-yl]-5-{[(1-formyl-2,2-dimethylpropyl)amino]carbonyl}benzoic acid
- 2-[2-[[4-(diaminomethyl)phenyl]carbamoyl]-6-methoxy-3-pyridyl]-5-[[(1s)-1-formyl-2,2-dimethyl-propyl]carbamoyl]benzoic acid
- 2-[2-[[4-(diaminomethyl)phenyl]carbamoyl]-6-methoxy-pyridin-3-yl]-5-[[(2s)-3,3-dimethyl-1-oxo-butan-2-yl]carbamoyl]benzoic acid
- 2-[2-[[4-(diaminomethyl)phenyl]carbamoyl]-6-methoxypyridin-3-yl]-5-[[(2s)-3,3-dimethyl-1-oxobutan-2-yl]carbamoyl]benzoic acid
- 2-[2-[[[4-(diaminomethyl)phenyl]amino]-oxomethyl]-6-methoxy-3-pyridyl]-5-[[[(1s)-1-formyl-2,2-dimethylpropyl]amino]-oxomethyl]benzoic acid
- ono
|
| InChIKey |
XTFRBCPDFSHPBF-OAQYLSRUSA-N |
| QR Code |
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| Links |
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| DOI |
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| Downloads |
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|
| Elements |
H
C
O
N
|
| |
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