(S)-6-(4-Methoxy-benzyloxy)-2-nitro-6,7-dihydro-5H-imidazo(2,1-b)(1,3)oxazine

Substructure search Find similar structures

Basic information

CAS: 187235-34-3
Standard SMILES: COc1ccc(CO[C@@H]2COc3nc([N+](=O)[O-])cn3C2)cc1
InChIKey: USPZSXDGWAVDHJ-LBPRGKRZSA-N
Molecular formula: C14H15N3O5
Average molar mass: 305.29 g/mol
Monoisotopic mass: 305.10117059

Names & identifiers

Preferred name: (S)-6-(4-Methoxy-benzyloxy)-2-nitro-6,7-dihydro-5H-imidazo(2,1-b)(1,3)oxazine
IUPAC: (6S)-6-[(4-methoxyphenyl)methoxy]-2-nitro-6,7-dihydro-5H-imidazo[2,1-b][1,3]oxazine

Names & synonyms

187235-34-3(S)-6-(4-Methoxy-benzyloxy)-2-nitro-6,7-dihydro-5H-imidazo(2,1-b)(1,3)oxazinePA-736(6S)-6-[(4-methoxyphenyl)methoxy]-2-nitro-6,7-dihydro-5H-imidazo[2,1-b][1,3]oxazine(S)-6-((4-Methoxybenzyl)oxy)-2-nitro-6,7-dihydro-5H-imidazo[2,1-b][1,3]oxazine(S)-6-(4-Methoxy-benzyloxy)-2-nitro-6,7-dihydro-5H-imidazo[2,1-b][1,3]oxazineDTXSID80172017

Database identifiers

CAS: 187235-34-3
PubChem CID: 476501
DTXSID: DTXSID80172017

Properties

Computed structural properties

XLogP: 1.6
Topological polar surface area: 91.3 Å²
Hydrogen bond donors: 0
Hydrogen bond acceptors: 6
Rotatable bonds: 4
Heavy atoms: 22
Formal charge: 0
Complexity: 383

Related reactions

0 records

New reaction record

No reaction records under the current filter.

Compound notes

Loading…