Molecules/(2S,4R)-1-acetyl-N-[(2S)-1-(1,3-benzothiazol-2-yl)-5-(diaminomethylideneamino)-1,1-dihydroxypentan-2-yl]-4-hydroxypyrrolidine-2-carboxamide

(2S,4R)-1-acetyl-N-[(2S)-1-(1,3-benzothiazol-2-yl)-5-(diaminomethylideneamino)-1,1-dihydroxypentan-2-yl]-4-hydroxypyrrolidine-2-carboxamide

C20H28N6O5S464.50 g/molCID 447332

Compare

Molecular Identity

(2S,4R)-1-acetyl-N-[(2S)-1-(1,3-benzothiazol-2-yl)-5-(diaminomethylideneamino)-1,1-dihydroxypentan-2-yl]-4-hydroxypyrrolidine-2-carboxamide

PubChem CID: 447332

2D Structure

Properties

C₂₀H₂₈N₆O₅S

Molecular Formula

464.50

Molecular Weight

g/mol

464.1842

Exact Mass

-1.6

XLogP

Drug-like (Lipinski: < 5)

216

TPSA

May have limited oral absorption

H-Bond Donors

H-Bond Acceptors

719

Complexity

SMILES

Canonical SMILES

SMILES: CC(=O)N1CC(CC1C(=O)NC(CCCN=C(N)N)C(C2=NC3=CC=CC=C3S2)(O)O)O

Isomeric SMILES

SMILES: CC(=O)N1C[C@@H](C[C@H]1C(=O)N[C@@H](CCCN=C(N)N)C(C2=NC3=CC=CC=C3S2)(O)O)O

Synonyms(1)

ABB

Data from PubChem (NCBI)

This platform is for informational purposes only and does not constitute medical advice. Always consult a qualified healthcare professional.

Molecular Structure

(2S,4R)-1-acetyl-N-[(2S)-1-(1,3-benzothiazol-2-yl)-5-(diaminomethylideneamino)-1,1-dihydroxypentan-2-yl]-4-hydroxypyrrolidine-2-carboxamide

Loading structure...

2D molecular structure of (2S,4R)-1-acetyl-N-[(2S)-1-(1,3-benzothiazol-2-yl)-5-(diaminomethylideneamino)-1,1-dihydroxypentan-2-yl]-4-hydroxypyrrolidine-2-carboxamide

Source: PubChem

Drug Network

Trials and conditions connected to (2S,4R)-1-acetyl-N-[(2S)-1-(1,3-benzothiazol-2-yl)-5-(diaminomethylideneamino)-1,1-dihydroxypentan-2-yl]-4-hydroxypyrrolidine-2-carboxamide

Loading drug network...