Protactin
TL;DR: Protactin (CAS 141912-59-6) is a chemical compound with molecular formula C32H48N6O8 and molecular weight 644.35333 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(2S)-1-[(2R)-2-[[(2S,3R)-2-[(2-amino-3-hydroxy-4-methylbenzoyl)amino]-3-hydroxybutanoyl]amino]-3-methylbut-3-enoyl]-N,5-dimethyl-N-[2-[methyl-[(2S)-3-methyl-1-oxobutan-2-yl]amino]-2-oxoethyl]pyrrolidine-2-carboxamide
Also Known As: Protactin, 4-Methyl-3-hydroxyanthraniloylpentapetidelactone, (2S)-1-[(2R)-2-[[(2S,3R)-2-[(2-amino-3-hydroxy-4-methylbenzoyl)amino]-3-hydroxybutanoyl]amino]-3-methylbut-3-enoyl]-N,5-dimethyl-N-[2-[methyl-[(2S)-3-methyl-1-oxobutan-2-yl]amino]-2-oxoethyl]pyrrolidine-2-carboxamide, (2S)-1-((R)-2-((2S,3R)-2-(2-amino-3-hydroxy-4-methylbenzamido)-3-hydroxybutanamido)-3-methylbut-3-enoyl)-N,5-dimethyl-N-(2-(methyl((S)-3-methyl-1-oxobutan-2-yl)amino)-2-oxoethyl)pyrrolidine-2-carboxamide, L-Valine, N-(N-(1-(N-(N-(2-amino-3-hydroxy-4-methylbenzoyl)-L-threonyl)-D-valyl)-5-methylprolyl)-N-methylglycyl)-N-methyl-, xi-lactone
Technical Specifications
| Molecular Formula | C32H48N6O8 |
| Molecular Weight | 644.35333 g/mol |
| XLogP | 2.1 |
| Topological Polar Surface Area (TPSA) | 203.0 Ų |
| Hydrogen Bond Donors | 5 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 13 |
| Exact Mass | 644.35333 Da |
| Heavy Atoms | 46 |
| Complexity | 1160.0 |
| SMILES | CC1CC[C@H](N1C(=O)[C@@H](C(=C)C)NC(=O)[C@H]([C@@H](C)O)NC(=O)C2=C(C(=C(C=C2)C)O)N)C(=O)N(C)CC(=O)N(C)[C@H](C=O)C(C)C |
| InChIKey | XZQTTYYQLUHMIZ-ZEVMZUSBSA-N |
Chemical Property Profile of Protactin
Property Insights of Protactin
The XLogP value of 2.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Protactin. The TPSA of 203.0 Ų indicates high polarity, suggesting Protactin may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Protactin has 5 hydrogen bond donor(s) and 9 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of Protactin?
The CAS number of Protactin is 141912-59-6.
What is the molecular formula of Protactin?
The molecular formula of Protactin is C32H48N6O8.
What is the molecular weight of Protactin?
The molecular weight of Protactin is 644.35333 g/mol.
Where can I buy Protactin?
You can request a quote for Protactin directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Protactin?
Yes, CoreyChem provides custom synthesis services for Protactin and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.