| Formula |
C29H42N6O4 |
| IUPAC Name |
4-[[(3s)-1-[2-[(2s)-2-[2-(6-carbamimidoyl-1-ethyl-indol-2-yl)ethyl]pyrrolidin-1-yl]-2-oxo-ethyl]-2-oxo-azepan-3-yl]amino]butanoic acid |
| Molecular Mass |
538.682 g·mol−1 |
| Heat of Formation |
-640.0 ± 16.7 kJ·mol−1 |
| Dipole Moment |
5.68 ± 1.08 D |
| Volume |
688.17 Å 3 |
| Surface Area |
524.73 Å 2 |
| HOMO Energy |
-8.28 ± 0.55 eV |
| LUMO Energy |
0.03 ± eV |
| Point Group Symmetry |
C1
|
| Synonyms
|
- 4-[[(3s)-1-[2-[(2s)-2-[2-(6-amidino-1-ethyl-indol-2-yl)ethyl]pyrrolidin-1-yl]-2-keto-ethyl]-2-keto-azepan-3-yl]amino]butyric acid
- 4-[[(3s)-1-[2-[(2s)-2-[2-(6-carbamimidoyl-1-ethyl-2-indolyl)ethyl]-1-pyrrolidinyl]-2-oxoethyl]-2-oxo-3-azepanyl]amino]butanoic acid
- 4-[[(3s)-1-[2-[(2s)-2-[2-(6-carbamimidoyl-1-ethyl-indol-2-yl)ethyl]pyrrolidin-1-yl]-2-oxo-ethyl]-2-oxo-azepan-3-yl]amino]butanoic acid
- 4-[[(3s)-1-[2-[(2s)-2-[2-(6-carbamimidoyl-1-ethylindol-2-yl)ethyl]pyrrolidin-1-yl]-2-oxoethyl]-2-oxoazepan-3-yl]amino]butanoic acid
|
| InChIKey |
DTJAQQZJSTVZRK-UPVQGACJSA-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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