Paclitaxel Photodegradant Impurity
TL;DR: Paclitaxel Photodegradant Impurity (CAS 146139-03-9) is a chemical compound with molecular formula C47H51NO14 and molecular weight 853.33093 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
[(2R,4S,5S,7R,10S,12S,13S,15S,16S)-2,10-diacetyloxy-15-[(2R,3S)-3-benzamido-2-hydroxy-3-phenylpropanoyl]oxy-5,13-dihydroxy-4,16,17,17-tetramethyl-3-oxo-8-oxapentacyclo[11.3.1.01,11.04,11.07,10]heptadecan-12-yl] benzoate
Also Known As: Paclitaxel Photodegradant, Paclitaxel Photodegradant Impurity, (1S,2S,4S,5S,6R,7aS,8S,9aR,11aS)-4-(((2R,3S)-3-benzamido-2-hydroxy-3-phenylpropanoyl)oxy)-1-(benzoyloxy)-2,8-dihydroxy-5,7a,12,12-tetramethyl-7-oxodecahydro-1H-2,5a-methanocyclohepta[3,3a]indeno[5,4-b]oxete-6,11a(11H)-diyl diacetate
Technical Specifications
| Molecular Formula | C47H51NO14 |
| Molecular Weight | 853.33093 g/mol |
| XLogP | 3.8 |
| Topological Polar Surface Area (TPSA) | 221.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 14 |
| Rotatable Bonds | 14 |
| Exact Mass | 853.33093 Da |
| Heavy Atoms | 62 |
| Complexity | 1820.0 |
| SMILES | C[C@@H]1[C@H](C[C@]2([C@H](C34C1(C2(C)C)[C@H](C(=O)[C@@]3([C@H](C[C@@H]5[C@]4(CO5)OC(=O)C)O)C)OC(=O)C)OC(=O)C6=CC=CC=C6)O)OC(=O)[C@@H]([C@H](C7=CC=CC=C7)NC(=O)C8=CC=CC=C8)O |
| InChIKey | DVCCAPSSSZMPLX-CSQSQHKQSA-N |
Chemical Property Profile of Paclitaxel Photodegradant Impurity
Property Insights of Paclitaxel Photodegradant Impurity
The XLogP value of 3.8 indicates that Paclitaxel Photodegradant Impurity is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 221.0 Ų indicates high polarity, suggesting Paclitaxel Photodegradant Impurity may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Paclitaxel Photodegradant Impurity has 4 hydrogen bond donor(s) and 14 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of Paclitaxel Photodegradant Impurity?
The CAS number of Paclitaxel Photodegradant Impurity is 146139-03-9.
What is the molecular formula of Paclitaxel Photodegradant Impurity?
The molecular formula of Paclitaxel Photodegradant Impurity is C47H51NO14.
What is the molecular weight of Paclitaxel Photodegradant Impurity?
The molecular weight of Paclitaxel Photodegradant Impurity is 853.33093 g/mol.
Where can I buy Paclitaxel Photodegradant Impurity?
You can request a quote for Paclitaxel Photodegradant Impurity directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Paclitaxel Photodegradant Impurity?
Yes, CoreyChem provides custom synthesis services for Paclitaxel Photodegradant Impurity and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.