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2-[[4-Methyl-2-(phenylmethoxycarbonylamino)pentanoyl]amino]-4-methylsulfanylbutanoic acid

HCID 333335
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Basic information

CAS
18830-16-5
Standard SMILES
CSCCC(NC(=O)C(CC(C)C)NC(=O)OCc1ccccc1)C(=O)O
InChIKey
IZPLXRUAUHMTGJ-UHFFFAOYSA-N
Molecular formula
C19H28N2O5S
Average molar mass
396.5 g/mol
Monoisotopic mass
396.17189317

Names & identifiers

Preferred name
2-[[4-Methyl-2-(phenylmethoxycarbonylamino)pentanoyl]amino]-4-methylsulfanylbutanoic acid
IUPAC
2-[[4-methyl-2-(phenylmethoxycarbonylamino)pentanoyl]amino]-4-methylsulfanylbutanoic acid
English name
Z-Leu-Met-OH
Molecular formula
C19H28N2O5S
Molecular weight
396.5

Names & synonyms

NSC3337602-[[4-methyl-2-(phenylmethoxycarbonylamino)pentanoyl]amino]-4-methylsulfanylbutanoic acidDTXSID90940325NSC-333760N-(2-{[(Benzyloxy)(hydroxy)methylidene]amino}-1-hydroxy-4-methylpentylidene)methionineZ-Leu-Met-OHEinecs 242-612-2N-Z-L-Leu-L-Met-OHZ-L-LEUCYL-L-METHIONINEN-[N-[(phenylmethoxy)carbonyl]-L-leucyl]-L-methionineL-Methionine, N-[(phenylmethoxy)carbonyl]-L-leucyl- (9CI)

Database identifiers

CAS
18830-16-5
PubChem CID
333335
DTXSID
DTXSID90940325

Properties

Computed structural properties

XLogP
3.1
Topological polar surface area
130 Ų
Hydrogen bond donors
3
Hydrogen bond acceptors
6
Rotatable bonds
12
Heavy atoms
27
Formal charge
0
Complexity
481

Physicochemical properties

Boiling point
649.1 · 649.1±55.0 °C(Predicted)
Density
1.195 · 1.195±0.06 g/cm3(Predicted)
storage temp.
-15 °C · -15°C
pka
3.33 · 3.33±0.10(Predicted)

Chemistry & industry

Suppliers8 total

陕西缔都新材料有限公司029-63373950 17392216152 · [email protected]
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]
南京肽业生物科技有限公司025-58361106-805 15951641583 · [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]

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