Basic information
- CAS
38972-90-6- Standard SMILES
CC(C)CC(NC(=O)C(Cc1cnc[nH]1)NC(=O)OCc1ccccc1)C(=O)O- InChIKey
QDSCJZMMRKBXNR-UHFFFAOYSA-N- Molecular formula
- C20H26N4O5
- Average molar mass
- 402.4 g/mol
- Monoisotopic mass
- 402.19031994
Names & identifiers
- Preferred name
- N-[(Benzyloxy)carbonyl]histidylleucine
- IUPAC
- 2-[[3-(1H-imidazol-5-yl)-2-(phenylmethoxycarbonylamino)propanoyl]amino]-4-methylpentanoic acid
- English name
- Z-HIS-LEU-OH
- Molecular formula
- C20H26N4O5
- Molecular weight
- 402.45
Names & synonyms
38972-90-6N-[(Benzyloxy)carbonyl]histidylleucine2-[[3-(1H-imidazol-5-yl)-2-(phenylmethoxycarbonylamino)propanoyl]amino]-4-methylpentanoic acidZ-His-Leu-OHNSC333461DTXSID00318637NSC-3334612-[[3-(3H-imidazol-4-yl)-2-phenylmethoxycarbonylamino-propanoyl]amino]-4-methyl-pentanoic acidFH111487DS-012758L-Leucine, N-[N-[(phenylmethoxy)carbonyl]-L-histidyl]- (9CI)2-[[3-(1H-imidazol-5-yl)-2-(phenylmethoxycarbonylamino)propanoyl]amino]-4-methylpentanoicacid
Database identifiers
- CAS
38972-90-6- PubChem CID
- 333228
- DTXSID
DTXSID00318637
Properties
Computed structural properties
- XLogP
- 2.3
- Topological polar surface area
- 133 Ų
- Hydrogen bond donors
- 4
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 11
- Heavy atoms
- 29
- Formal charge
- 0
- Complexity
- 551
Physicochemical properties
- Melting point
- 185 · 185-188 °C
- Boiling point
- 760.5 · 760.5±60.0 °C(Predicted)
- Density
- 1.269 · 1.269±0.06 g/cm3(Predicted)
- storage temp.
- -15 °C · -15°C
- pka
- 3.35 · 3.35±0.10(Predicted)
Chemistry & industry
Upstream & downstream products
Upstream raw materials
Suppliers6 total
梯希爱（上海）化工贸易有限公司021-61109150 · [email protected]
上海瀚鸿科技股份有限公司021-54306202 13764082696 · [email protected]
凯试(上海)科技有限公司021-50135380 · [email protected]
成都云希化工有限公司+86-17380623303 · [email protected]
上海瀚鸿科技股份有限公司021-54306202 18917919676 · [email protected]
吉尔生化(上海)有限公司21-61263452 13641803416 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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