C19H27N7O5.5/4H2O
TL;DR: C19H27N7O5.5/4H2O (CAS 128055-85-6) is a chemical compound with molecular formula C19H27N7O5 and molecular weight 433.20737 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
N-[(2S)-3-(1H-imidazol-5-yl)-1-[methyl-[(2S)-1-methylpyrrolidine-2-carbonyl]amino]-1-oxopropan-2-yl]-1-methyl-2,6-dioxo-1,3-diazinane-4-carboxamide
Also Known As: C19H27N7O5.5/4H2O, C19-H27-N7-O5.5/4H2-O, L-Prolinamide, N-((hexahydro-1-methyl-2,6-dioxo-4-pyrimidinyl)carbonyl)-L-histidyl-N,N-dimethyl-, hydrate (4:5), 2-Hydroxy-N-{3-(1H-imidazol-5-yl)-1-[methyl(1-methylpyrrolidine-2-carbonyl)amino]-1-oxopropan-2-yl}-1-methyl-6-oxo-1,4,5,6-tetrahydropyrimidine-4-carboximidic acid, N-[(2S)-1-[(2S)-N,1-Dimethylpyrrolidine-2-carboxamido]-3-(1H-imidazol-5-yl)-1-oxopropan-2-yl]-2-hydroxy-1-methyl-6-oxo-1,4,5,6-tetrahydropyrimidine-4-carboximidic acid
Technical Specifications
| Molecular Formula | C19H27N7O5 |
| Molecular Weight | 433.20737 g/mol |
| XLogP | -1.5 |
| Topological Polar Surface Area (TPSA) | 148.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 6 |
| Exact Mass | 433.20737 Da |
| Heavy Atoms | 31 |
| Complexity | 760.0 |
| SMILES | CN1CCC[C@H]1C(=O)N(C)C(=O)[C@H](CC2=CN=CN2)NC(=O)C3CC(=O)N(C(=O)N3)C |
| InChIKey | AKYDUPRENMRLHD-TTZKSVMKSA-N |
Chemical Property Profile of C19H27N7O5.5/4H2O
Property Insights of C19H27N7O5.5/4H2O
The XLogP value of -1.5 indicates that C19H27N7O5.5/4H2O is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 148.0 Ų indicates high polarity, suggesting C19H27N7O5.5/4H2O may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, C19H27N7O5.5/4H2O has 3 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of C19H27N7O5.5/4H2O?
The CAS number of C19H27N7O5.5/4H2O is 128055-85-6.
What is the molecular formula of C19H27N7O5.5/4H2O?
The molecular formula of C19H27N7O5.5/4H2O is C19H27N7O5.
What is the molecular weight of C19H27N7O5.5/4H2O?
The molecular weight of C19H27N7O5.5/4H2O is 433.20737 g/mol.
Where can I buy C19H27N7O5.5/4H2O?
You can request a quote for C19H27N7O5.5/4H2O directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for C19H27N7O5.5/4H2O?
Yes, CoreyChem provides custom synthesis services for C19H27N7O5.5/4H2O and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.