Azd-8848
methyl 2-[3-[[3-(6-amino-2-butoxy-8-oxo-7H-purin-9-yl)propyl-(3-morpholin-4-ylpropyl)amino]methyl]phenyl]acetate
Molecular Identity
Azd-8848
methyl 2-[3-[[3-(6-amino-2-butoxy-8-oxo-7H-purin-9-yl)propyl-(3-morpholin-4-ylpropyl)amino]methyl]phenyl]acetate
PubChem CID: 11592228
2D Structure
Properties
C29H43N7O5
Molecular Formula
569.70
Molecular Weight
g/mol
569.3326
Exact Mass
Da
2.3
XLogP
Drug-like (Lipinski: < 5)
135
TPSA
Good oral absorption (< 140 A²)
2
H-Bond Donors
10
H-Bond Acceptors
802
Complexity
SMILES
Canonical SMILES
SMILES: CCCCOC1=NC(=C2C(=N1)N(C(=O)N2)CCCN(CCCN3CCOCC3)CC4=CC=CC(=C4)CC(=O)OC)NIsomeric SMILES
SMILES: CCCCOC1=NC(=C2C(=N1)N(C(=O)N2)CCCN(CCCN3CCOCC3)CC4=CC=CC(=C4)CC(=O)OC)NSynonyms(20)
AZD8848866269-28-5AZD-8848DSP-3025322ZMR6920methyl 2-(3-(((3-(6-amino-2-butoxy-8-oxo-7,8-dihydro-9H-purin-9-yl)propyl)(3-morpholinopropyl)amino)methyl)phenyl)acetateMethyl 2-(3-(((3-(6-amino-2-butoxy-8-oxo-7H-purin-9(8H)-yl)propyl)(3-morpholinopropyl)amino)methyl)phenyl)acetateBenzeneacetic acid, 3-(((3-(6-amino-2-butoxy-7,8-dihydro-8-oxo-9H-purin-9-yl)propyl)(3-(4-morpholinyl)propyl)amino)methyl)-, methyl esterRefChem:116022methyl 2-(3-(((3-(6-amino-2-butoxy-8-oxo-8,9-dihydro-7H-purin-9-yl)propyl)(3-(morpholin-4-yl)propyl)amino)methyl)phenyl)acetateUNII-322ZMR6920methyl 2-[3-[[3-(6-amino-2-butoxy-8-oxo-7H-purin-9-yl)propyl-(3-morpholin-4-ylpropyl)amino]methyl]phenyl]acetate866269-28-5 (free base)GTPL9256orb1710346
Data from PubChem (NCBI)
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Drug Network
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