TL;DR: N-Benzyl-1,4-dideoxy-1,4-imino-D-ribitol (CAS 141434-65-3) is a chemical compound with molecular formula C12H17NO3 and molecular weight 223.12085 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(2R,3R,4S)-1-benzyl-2-(hydroxymethyl)pyrrolidine-3,4-diol
Also Known As: BzDRib, N-Benzyl-1,4-dideoxy-1,4-imino-D-ribitol, (2R,3R,4S)-1-benzyl-2-(hydroxymethyl)pyrrolidine-3,4-diol, 3,4-Pyrrolidinediol, 2-(hydroxymethyl)-1-(phenylmethyl)-, (2alpha,3beta,4beta)-, 3,4-Pyrrolidinediol, 2-(hydroxymethyl)-1-(phenylmethyl)-, (2a,3b,4b)-
Top 5 of 4 IPC patent classification(s) from the SureChEMBL global patent database.
| Molecular Formula | C12H17NO3 |
| Molecular Weight | 223.12085 g/mol |
| XLogP | 0.2 |
| Topological Polar Surface Area (TPSA) | 63.9 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 223.12085 Da |
| Heavy Atoms | 16 |
| Complexity | 218.0 |
| SMILES | C1[C@@H]([C@@H]([C@H](N1CC2=CC=CC=C2)CO)O)O |
| InChIKey | SBDAWMSBMQBJRA-GRYCIOLGSA-N |
The XLogP value of 0.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-Benzyl-1,4-dideoxy-1,4-imino-D-ribitol. The TPSA of 63.9 Ų falls within the moderate polarity range, balancing permeability and solubility for N-Benzyl-1,4-dideoxy-1,4-imino-D-ribitol. Following Lipinski's Rule of Five, N-Benzyl-1,4-dideoxy-1,4-imino-D-ribitol has 3 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of N-Benzyl-1,4-dideoxy-1,4-imino-D-ribitol is 141434-65-3.
The molecular formula of N-Benzyl-1,4-dideoxy-1,4-imino-D-ribitol is C12H17NO3.
The molecular weight of N-Benzyl-1,4-dideoxy-1,4-imino-D-ribitol is 223.12085 g/mol.
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