Basic information
- CAS
1216941-97-7- Standard SMILES
C=CCCCCC[C@H](NC(=O)c1cnc(C)cn1)C(=O)O- InChIKey
VRYQWFBVHILOGF-LBPRGKRZSA-N- Molecular formula
- C15H21N3O3
- Average molar mass
- 291.35 g/mol
- Monoisotopic mass
- 291.15829153
Names & identifiers
- Preferred name
- (S)-2-(5-methylpyrazine-2-carboxamido)non-8-enoic acid
- IUPAC
- (2S)-2-[(5-methylpyrazine-2-carbonyl)amino]non-8-enoic acid
- English name
- (S)-2-(5-methylpyrazine-2-carboxamido)non-8-enoic acid
- Molecular formula
- C15H21N3O3
- Molecular weight
- 291.35
Names & synonyms
1216941-97-7(2S)-2-[(5-methylpyrazin-2-yl)formamido]non-8-enoic acidL-Norleucine, N-[(5-methyl-2-pyrazinyl)carbonyl]-6-(2-propen-1-yl)-(S)-2-(5-methylpyrazine-2-carboxamido)non-8-enoic acidSCHEMBL2151364N-[(5-Methyl-2-pyrazinyl)carbonyl]-6-(2-propen-1-yl)-L-norleucineVRYQWFBVHILOGF-LBPRGKRZSA-NDTXSID101335217NS00077297(2S)-2-[(5-methylpyrazine-2-carbonyl)amino]non-8-enoic acid(2S)-2-{[(5-Methyl-2-pyrazinyl)carbonyl]amino}-8-nonenoic acid
Database identifiers
- CAS
1216941-97-7- PubChem CID
- 67296752
- DTXSID
DTXSID101335217- Nikkaji
- J2.918.838F
Properties
Computed structural properties
- XLogP
- 2.3
- Topological polar surface area
- 92.2 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 9
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 360
Chemistry & industry
Suppliers2 total
ATK CHEMICAL COMPANY LIMITED+undefined-21-51877795 · [email protected]
郑州艾克姆化工有限公司0371-63315541 13323832564 · [email protected]
Related reactions
6 records
Compound notes
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