Acetamide, N-(4-(2-(8-cyclopentyl-1,2,6,7-tetrahydro-2,6-dioxo-1-propyl-3H-purin-3-yl)ethyl)phenyl)-
Basic information
- CAS
149744-75-2- Standard SMILES
CCCn1c(=O)c2[nH]c(C3CCCC3)nc2n(CCc2ccc(NC(C)=O)cc2)c1=O- InChIKey
XOFKHHZMYBONCM-UHFFFAOYSA-N- Molecular formula
- C23H29N5O3
- Average molar mass
- 423.5 g/mol
- Monoisotopic mass
- 423.2270398
Names & identifiers
- Preferred name
- Acetamide, N-(4-(2-(8-cyclopentyl-1,2,6,7-tetrahydro-2,6-dioxo-1-propyl-3H-purin-3-yl)ethyl)phenyl)-
- IUPAC
- N-[4-[2-(8-cyclopentyl-2,6-dioxo-1-propyl-7H-purin-3-yl)ethyl]phenyl]acetamide
- English name
- N-[4-[2-(8-cyclopentyl-2,6-dioxo-1-propyl-7H-purin-3-yl)ethyl]phenyl]a cetamide
- Molecular formula
- C23H29N5O3
- Molecular weight
- 423.51
Names & synonyms
149744-75-2Acetamide, N-(4-(2-(8-cyclopentyl-1,2,6,7-tetrahydro-2,6-dioxo-1-propyl-3H-purin-3-yl)ethyl)phenyl)-3-(4-Acetylaminophenethyl)-8-cyclopentyl 1-propylxanthineDTXSID00164378RefChem:315305DTXCID3086869CHEMBL421526N-(4-(2-(8-Cyclopentyl-2,6-dioxo-1-propyl-1H-purin-3(2H,6H,9H)-yl)ethyl)phenyl)acetamideN-{4-[2-(8-cyclopentyl-2,6-dioxo-1-propyl-2,3,6,9-tetrahydro-1H-purin-3-yl)ethyl]phenyl}acetamideN-[4-[2-(8-cyclopentyl-2,6-dioxo-1-propyl-7H-purin-3-yl)ethyl]phenyl]acetamideSCHEMBL9402220BDBM50231015
Show more names
N-[4-[2-(8-cyclopentyl-2,6-dioxo-1-propyl-7H-purin-3-yl)ethyl]phenyl]a cetamideAcetamide, N-[4-[2-(8-cyclopentyl-1,2,6,9-tetrahydro-2,6-dioxo-1-propyl-3H-purin-3-yl)ethyl]phenyl]-
N-{4-[2-(8-Cyclopentyl-2,6-dioxo-1-propyl-1,2,6,7-tetrahydro-3H-purin-3-yl)ethyl]phenyl}acetamide
Properties
Computed structural properties
- XLogP
- 4.2
- Topological polar surface area
- 98.4 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 7
- Heavy atoms
- 31
- Formal charge
- 0
- Complexity
- 672
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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