Aminodiol deriv. 15b
TL;DR: Aminodiol deriv. 15b (CAS 162538-18-3) is a chemical compound with molecular formula C30H45N3O7 and molecular weight 559.32574 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
tert-butyl N-[(2S,3R)-3-hydroxy-4-[[(2R,3S)-2-hydroxy-4-(4-hydroxyphenyl)-3-[(2-methylpropan-2-yl)oxycarbonylamino]butyl]amino]-1-phenylbutan-2-yl]carbamate
Also Known As: Aminodiol deriv. 15b, BMS-186318 analog 4, Aminodiol isostere, Bn 4OHBn deriv., 12-Oxa-2,6,10-triazatetradecanoic acid, 4,8-dihydroxy-3-((4-hydroxyphenyl)methyl)-13,13-dimethyl-11-oxo-9-(phenylmethyl)-, 1,1-dimethylethyl ester, (3S-(3R*,4S*,8S*,9R*))-, (1S-(1R,2S(2S,3R)))-(3-((3-(((1,1-Dimethylethylethoxy)carbonyl)amino)-2-hydroxy-4-(4-hydroxyphenyl)butyl)amino)-2-hydroxy-1-(phenylmethyl)propyl)carbamic acid, 1,1-dimethylethyl ester
Technical Specifications
| Molecular Formula | C30H45N3O7 |
| Molecular Weight | 559.32574 g/mol |
| XLogP | 3.7 |
| Topological Polar Surface Area (TPSA) | 149.0 Ų |
| Hydrogen Bond Donors | 6 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 16 |
| Exact Mass | 559.32574 Da |
| Heavy Atoms | 40 |
| Complexity | 753.0 |
| SMILES | CC(C)(C)OC(=O)N[C@@H](CC1=CC=CC=C1)[C@@H](CNC[C@H]([C@H](CC2=CC=C(C=C2)O)NC(=O)OC(C)(C)C)O)O |
| InChIKey | QVGOLNUEBCOLGS-QEGGNFSNSA-N |
Chemical Property Profile of Aminodiol deriv. 15b
Property Insights of Aminodiol deriv. 15b
The XLogP value of 3.7 indicates that Aminodiol deriv. 15b is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 149.0 Ų indicates high polarity, suggesting Aminodiol deriv. 15b may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Aminodiol deriv. 15b has 6 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of Aminodiol deriv. 15b?
The CAS number of Aminodiol deriv. 15b is 162538-18-3.
What is the molecular formula of Aminodiol deriv. 15b?
The molecular formula of Aminodiol deriv. 15b is C30H45N3O7.
What is the molecular weight of Aminodiol deriv. 15b?
The molecular weight of Aminodiol deriv. 15b is 559.32574 g/mol.
Where can I buy Aminodiol deriv. 15b?
You can request a quote for Aminodiol deriv. 15b directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Aminodiol deriv. 15b?
Yes, CoreyChem provides custom synthesis services for Aminodiol deriv. 15b and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.