| Formula |
C29H31N7O3 |
| IUPAC Name |
[4-[[6-[1-[(e)-n-(2-ethoxy-2-oxo-ethoxy)-c-(3h-pyridin-1-ium-3-id-2-yl)carbonimidoyl]cyclopropyl]-3-methyl-1h-benzimidazol-2-id-2-yl]methylamino]benzenecarboximidoyl]azanide |
| Molecular Mass |
525.602 g·mol−1 |
| Heat of Formation |
252.8 ± 16.7 kJ·mol−1 |
| Dipole Moment |
7.14 ± 1.08 D |
| Volume |
629.76 Å 3 |
| Surface Area |
544.79 Å 2 |
| HOMO Energy |
-8.62 ± 0.55 eV |
| LUMO Energy |
-0.73 ± eV |
| Point Group Symmetry |
C1
|
| Synonyms
|
- 2-[[[1-[2-[[(4-amidinophenyl)amino]methyl]-1-methyl-benzimidazol-5-yl]cyclopropyl]-(2-pyridyl)methylene]amino]oxyacetic acid ethyl ester
- 2-[[[1-[2-[[(4-carbamimidoylphenyl)amino]methyl]-1-methyl-5-benzimidazolyl]cyclopropyl]-(2-pyridyl)methylene]amino]oxyacetic acid ethyl ester
- [(1-{2[(4-carbamimidoyl-phenylamino)-methyl]-1-methyl-1h-benzoimidazol-5-yl}-cyclopropyl)-pyridin-2-yl-methyleneaminooxy]-acetic acid ethyl ester
- ethyl 2-[[[1-[2-[[(4-carbamimidoylphenyl)amino]methyl]-1-methyl-benzimidazol-5-yl]cyclopropyl]-(2-pyridyl)methylene]amino]oxyacetate
- ethyl 2-[[[1-[2-[[(4-carbamimidoylphenyl)amino]methyl]-1-methyl-benzimidazol-5-yl]cyclopropyl]-pyridin-2-yl-methylidene]amino]oxyethanoate
- ethyl 2-[[[1-[2-[[(4-carbamimidoylphenyl)amino]methyl]-1-methylbenzimidazol-5-yl]cyclopropyl]-pyridin-2-ylmethylidene]amino]oxyacetate
- t87
|
| InChIKey |
RNOYCNIZOAIUSV-LSWMGQQCSA-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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