Formula |
C19H21ClF3N5O2 |
IUPAC Name |
2-[6-chloro-3-[(2,2-difluoro-2-phenyl-ethyl)amino]-2-fluoro-phenyl]-n-(2-guanidinooxyethyl)acetamide |
Molecular Mass |
443.851 g·mol−1 |
Heat of Formation |
-688.7 ± 16.7 kJ·mol−1 |
Dipole Moment |
3.76 ± 1.08 D |
Volume |
481.23 Å 3 |
Surface Area |
407.86 Å 2 |
HOMO Energy |
-8.59 ± 0.55 eV |
LUMO Energy |
2.44 ± eV |
Point Group Symmetry |
C1
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Synonyms
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- 2-[6-chloro-3-[(2,2-difluoro-2-phenyl-ethyl)amino]-2-fluoro-phenyl]-n-(2-guanidinooxyethyl)acetamide
- 2-[6-chloro-3-[(2,2-difluoro-2-phenyl-ethyl)amino]-2-fluoro-phenyl]-n-[2-(diaminomethylideneamino)oxyethyl]ethanamide
- 2-[6-chloro-3-[(2,2-difluoro-2-phenylethyl)amino]-2-fluorophenyl]-n-(2-guanidinooxyethyl)acetamide
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InChIKey |
DZEJHPMTDNDECN-UHFFFAOYSA-N |
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Links |
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DOI |
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Downloads |
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Elements |
C
F
H
Cl
O
N
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