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Home Amines 66163-79-9
66163-79-9,MFCD09029421
Catalog No.:AA01X4I6

66163-79-9 | 5-Thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid, 3-[(acetyloxy)methyl]-8-oxo-7-[[(4-pyridinylthio)acetyl]amino]-, (6R,7R)-, compd. with N,N′-bis(phenylmethyl)-1,2-ethanediamine

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Technical Information
Catalog Number:
AA01X4I6
Chemical Name:
5-Thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid, 3-[(acetyloxy)methyl]-8-oxo-7-[[(4-pyridinylthio)acetyl]amino]-, (6R,7R)-, compd. with N,N′-bis(phenylmethyl)-1,2-ethanediamine
CAS Number:
66163-79-9
Molecular Formula:
C33H37N5O6S2
Molecular Weight:
663.8068
MDL Number:
MFCD09029421
SMILES:
N(Cc1ccccc1)CCNCc1ccccc1.O=C(N[C@@H]1C(=O)N2[C@@H]1SCC(=C2C(=O)O)COC(=O)C)CSc1ccncc1
Properties
Computed Properties
 
Complexity:
878  
Covalently-Bonded Unit Count:
3  
Defined Atom Stereocenter Count:
4  
Heavy Atom Count:
74  
Hydrogen Bond Acceptor Count:
20  
Hydrogen Bond Donor Count:
6  
Rotatable Bond Count:
23  

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SDS
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Tags:66163-79-9 Molecular Formula|66163-79-9 MDL|66163-79-9 SMILES|66163-79-9 5-Thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid, 3-[(acetyloxy)methyl]-8-oxo-7-[[(4-pyridinylthio)acetyl]amino]-, (6R,7R)-, compd. with N,N′-bis(phenylmethyl)-1,2-ethanediamine