C16H25N5O5.1/2H2O
TL;DR: C16H25N5O5.1/2H2O (CAS 128055-89-0) is a chemical compound with molecular formula C16H25N5O5 and molecular weight 367.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4S)-N-[(2S)-1-[(2S)-2-carbamoylpyrrolidin-1-yl]-1-oxopentan-2-yl]-1-methyl-2,6-dioxo-1,3-diazinane-4-carboxamide
Also Known As: C16H25N5O5.1/2H2O, C16-H25-N5-O5.1/2H2-O, L-Prolinamide, N-((hexahydro-1-methyl-2,6-dioxo-4-pyrimidinyl)carbonyl)-L-norvalyl-, (S)-, hemihydrate, (4S)-N-[(2S)-1-[(2S)-2-carbamoylpyrrolidin-1-yl]-1-oxopentan-2-yl]-1-methyl-2,6-dioxo-1,3-diazinane-4-carboxamide, N-[(4S)-1-Methyl-2,6-dioxo-1,3-diazinane-4-carbonyl]-L-norvalyl-L-prolinamide
| Molecular Formula | C16H25N5O5 |
|---|---|
| Molecular Weight | 367.19 g/mol |
| LogP | -1.3121 |
| Topological Polar Surface Area | 141.91 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 367.18558 |
| Heavy Atoms | 26 |
| Complexity | 604.15173 |
Chemical Identifiers
| CAS Number | 128055-89-0 |
|---|---|
| SMILES | CCC[C@@H](C(=O)N1CCC[C@H]1C(=O)N)NC(=O)[C@@H]2CC(=O)N(C(=O)N2)C |
Product Overview
C16H25N5O5.1/2H2O (CAS 128055-89-0), with molecular formula C16H25N5O5 and molecular weight 367.19 g/mol. IUPAC: (4S)-N-[(2S)-1-[(2S)-2-carbamoylpyrrolidin-1-yl]-1-oxopentan-2-yl]-1-methyl-2,6-dioxo-1,3-diazinane-4-carboxamide.
Chemical Property Profile of C16H25N5O5.1/2H2O
Property Insights of C16H25N5O5.1/2H2O
The XLogP value of -1.3121 indicates that C16H25N5O5.1/2H2O is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 141.91 Ų indicates high polarity, suggesting C16H25N5O5.1/2H2O may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, C16H25N5O5.1/2H2O has 3 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of C16H25N5O5.1/2H2O?
The CAS number of C16H25N5O5.1/2H2O is 128055-89-0.
What is the molecular formula of C16H25N5O5.1/2H2O?
The molecular formula of C16H25N5O5.1/2H2O is C16H25N5O5.
What is the molecular weight of C16H25N5O5.1/2H2O?
The molecular weight of C16H25N5O5.1/2H2O is 367.19 g/mol.
Where can I buy C16H25N5O5.1/2H2O?
You can request a quote for C16H25N5O5.1/2H2O directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for C16H25N5O5.1/2H2O?
Yes, KEHONG BIO provides custom synthesis services for C16H25N5O5.1/2H2O and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.