2-[[9-[3,4-dihydroxy-5-(methoxymethyl)oxolan-2-yl]-6-(2,2-diphenylethylamino)purin-2-yl]methylamino]-N,N-di(propan-2-yl)acetamide

HCID 18348440
Substructure searchFind similar structures

Basic information

Standard SMILES
COCC1OC(n2cnc3c(NCC(c4ccccc4)c4ccccc4)nc(CNCC(=O)N(C(C)C)C(C)C)nc32)C(O)C1O
InChIKey
QDZZQBFCMBJPMD-UHFFFAOYSA-N
Molecular formula
C34H45N7O5
Average molar mass
631.8 g/mol

Names & identifiers

Preferred name
2-[[9-[3,4-dihydroxy-5-(methoxymethyl)oxolan-2-yl]-6-(2,2-diphenylethylamino)purin-2-yl]methylamino]-N,N-di(propan-2-yl)acetamide
IUPAC
2-[[9-[3,4-dihydroxy-5-(methoxymethyl)oxolan-2-yl]-6-(2,2-diphenylethylamino)purin-2-yl]methylamino]-N,N-di(propan-2-yl)acetamide

Database identifiers

PubChem CID
18348440

Properties

Computed structural properties

XLogP
2.7
Topological polar surface area
147 Ų
Hydrogen bond donors
4
Hydrogen bond acceptors
10
Rotatable bonds
14
Heavy atoms
46

Related reactions

1 records
New reaction record

Linked notes

Loading…