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(4R,5S,6S,7R)-4,7-dibenzyl-1,3-bis(2-ethoxyethyl)-5,6-dihydroxy-1,3-diazepan-2-one

(4R,5S,6S,7R)-4,7-dibenzyl-1,3-bis(2-ethoxyethyl)-5,6-dihydroxy-1,3-diazepan-2-one structure

CAS No:
153182-63-9
Formula:
C27H38N2O5
Chemical Name:
(4R,5S,6S,7R)-4,7-dibenzyl-1,3-bis(2-ethoxyethyl)-5,6-dihydroxy-1,3-diazepan-2-one
Synonyms:
2H-1,3-Diazepin-2-one,1,3-bis(2-ethoxyethyl)hexahydro-5,6-dihydroxy-4,7-bis(phenylmethyl)-,[4R-(4a,5a,6b,7b)]; 2H-1,3-Diazepin-2-one,1,3-bis(2-ethoxyethyl)hexahydro-5,6-dihydroxy-4,7-bis(phenylmethyl)-,(4R,5S,6S,7R); Cyclic Urea 15;

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(4R,5S,6S,7R)-4,7-dibenzyl-1,3-bis(2-ethoxyethyl)-5,6-dihydroxy-1,3-diazepan-2-one Basic Attributes

Molecular Weight：

470.60100

Exact Mass：

470.27807232 g/mol

DSSTox ID：

DTXSID00165264

Characteristics

PSA：

82.47000

XLogP3：

2.61720

Density：

1.155g/cm3

Boiling Point：

621.1ºC

Flash Point：

329.4ºC

Refractive Index：

1.564

Vapor Pressure：

2.75E-16mmHg at 25°C

Computed Properties

Molecular Weight:470.6
XLogP3:2.8
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:12
Exact Mass:470.27807232
Monoisotopic Mass:470.27807232
Topological Polar Surface Area:82.5
Heavy Atom Count:34
Complexity:531
Defined Atom Stereocenter Count:4
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of (4R,5S,6S,7R)-4,7-dibenzyl-1,3-bis(2-ethoxyethyl)-5,6-dihydroxy-1,3-diazepan-2-one

Basic Attributes
Characteristics
Computed Properties

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