Formula |
C26H41ClN4O5 |
IUPAC Name |
methyl n-[2-[(r)-(3-chlorophenyl)-[(3r)-1-[[(2s)-2-(methylamino)-3-[(3r)-tetrahydropyran-3-yl]propyl]carbamoyl]-3-piperidyl]methoxy]ethyl]carbamate |
Molecular Mass |
525.081 g·mol−1 |
Heat of Formation |
-977.9 ± 16.7 kJ·mol−1 |
Dipole Moment |
2.29 ± 1.08 D |
Volume |
646.47 Å 3 |
Surface Area |
512.96 Å 2 |
HOMO Energy |
-8.94 ± 0.55 eV |
LUMO Energy |
-0.14 ± eV |
Point Group Symmetry |
C1
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Synonyms
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- methyl n-[2-[(r)-(3-chlorophenyl)-[(3r)-1-[[(2s)-2-methylamino-3-[(3r)-oxan-3-yl]propyl]carbamoyl]piperidin-3-yl]methoxy]ethyl]carbamate
- methyl n-[2-[(r)-(3-chlorophenyl)-[(3r)-1-[[(2s)-2-methylamino-3-[(3r)-tetrahydropyran-3-yl]propyl]carbamoyl]-3-piperidyl]methoxy]ethyl]carbamate
- n-[2-[(r)-(3-chlorophenyl)-[(3r)-1-[[(2s)-2-methylamino-3-[(3r)-tetrahydropyran-3-yl]propyl]carbamoyl]-3-piperidyl]methoxy]ethyl]carbamic acid methyl ester
- n-[2-[(r)-(3-chlorophenyl)-[(3r)-1-[[[(2s)-2-methylamino-3-[(3r)-3-tetrahydropyranyl]propyl]amino]-oxomethyl]-3-piperidinyl]methoxy]ethyl]carbamic acid methyl ester
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InChIKey |
NXWASIVXQMMPLM-ZXMXYHOLSA-N |
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Elements |
H
C
Cl
O
N
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