(S)-N-(1-benzyloxycarbonyl-5-benzyloxycarbonyl-amino-pent-1-yl)-N-[2'-(1-triphenylmethyl-1H-tetrazol-5-yl)biphenyl-4-ylmethyl]-amine

HCID 66577461
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Basic information

Standard SMILES
NC(CCC[C@H](NCc1ccc(-c2ccccc2-c2nnnn2C(c2ccccc2)(c2ccccc2)c2ccccc2)cc1)C(=O)OCc1ccccc1)C(=O)OCc1ccccc1
InChIKey
VSOLCXGAOLMSGS-GOOVXGPGSA-N
Molecular formula
C54H50N6O4
Average molar mass
847 g/mol

Names & identifiers

Preferred name
(S)-N-(1-benzyloxycarbonyl-5-benzyloxycarbonyl-amino-pent-1-yl)-N-[2'-(1-triphenylmethyl-1H-tetrazol-5-yl)biphenyl-4-ylmethyl]-amine
IUPAC
dibenzyl (6S)-2-amino-6-[[4-[2-(1-trityltetrazol-5-yl)phenyl]phenyl]methylamino]heptanedioate

Names & synonyms

SCHEMBL2441VSOLCXGAOLMSGS-GOOVXGPGSA-N(S)-N-(1-benzyloxycarbonyl-5-benzyloxycarbonyl-amino-pent-1-yl)-N-[2'-(1-triphenylmethyl-1H-tetrazol-5-yl)biphenyl-4-ylmethyl]-amine

Database identifiers

PubChem CID
66577461

Properties

Computed structural properties

XLogP
10
Topological polar surface area
134 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
9
Rotatable bonds
21
Heavy atoms
64

Related reactions

1 records
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Compound notes

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