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191474-13-2,MFCD02683972
Catalog No.:AA002F6S

191474-13-2 | 2,5-Methano-5H,9H-pyrimido[2,1-b][1,5,3]dioxazepin-9-one, 3-[[bis(4-methoxyphenyl)phenylmethoxy]methyl]-2,3-dihydro-8-methyl-, (2R,3R,5R)-

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Technical Information
Catalog Number:
AA002F6S
Chemical Name:
2,5-Methano-5H,9H-pyrimido[2,1-b][1,5,3]dioxazepin-9-one, 3-[[bis(4-methoxyphenyl)phenylmethoxy]methyl]-2,3-dihydro-8-methyl-, (2R,3R,5R)-
CAS Number:
191474-13-2
Molecular Formula:
C31H30N2O6
Molecular Weight:
526.5797
MDL Number:
MFCD02683972
SMILES:
COc1ccc(cc1)C(c1ccc(cc1)OC)(c1ccccc1)OC[C@H]1O[C@@H]2C[C@H]1Oc1n2cc(c(=O)n1)C
Properties
Computed Properties
 
Complexity:
905  
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
3  
Heavy Atom Count:
39  
Hydrogen Bond Acceptor Count:
6  
Rotatable Bond Count:
8  
XLogP3:
4.8  

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SDS
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Tags:191474-13-2 Molecular Formula|191474-13-2 MDL|191474-13-2 SMILES|191474-13-2 2,5-Methano-5H,9H-pyrimido[2,1-b][1,5,3]dioxazepin-9-one, 3-[[bis(4-methoxyphenyl)phenylmethoxy]methyl]-2,3-dihydro-8-methyl-, (2R,3R,5R)-