Basic information
- CAS
74151-36-3- Standard SMILES
CCN(CC)CCCC(C)Nc1nc(/C=C/c2c(Br)cc(Br)cc2Br)nc2ccc([N+](=O)[O-])cc12- InChIKey
FBIHIRPVQTVMTK-PKNBQFBNSA-N- Molecular formula
- C25H28Br3N5O2
- Average molar mass
- 670.2 g/mol
- Monoisotopic mass
- 666.97931
Names & identifiers
- Preferred name
- Quinazoline, 4-(4-(diethylamino)-1-methylbutylamino)-6-nitro-2-(2,4,6-tribromostyryl)-
- IUPAC
- 1-N,1-N-diethyl-4-N-[6-nitro-2-[(E)-2-(2,4,6-tribromophenyl)ethenyl]quinazolin-4-yl]pentane-1,4-diamine
Names & synonyms
Quinazoline, 4-(4-(diethylamino)-1-methylbutylamino)-6-nitro-2-(2,4,6-tribromostyryl)-74151-36-3RefChem:1097771BRN 53231742-(2,4,6-Tribromostyryl)-4-(delta-diethylamino-alpha-methylbutylamino)-6-nitroquinazoline
Database identifiers
- CAS
74151-36-3- PubChem CID
- 6149596
- Nikkaji
- J73.021A
Properties
Computed structural properties
- XLogP
- 8
- Topological polar surface area
- 86.9 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 10
- Heavy atoms
- 35
- Formal charge
- 0
- Complexity
- 681
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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