TL;DR: ritonavir (CAS 155213-67-5) is a chemical compound with molecular formula C37H48N6O5S2 and molecular weight 720.31274 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1,3-thiazol-5-ylmethyl N-[3-hydroxy-5-[[3-methyl-2-[[methyl-[(2-propan-2-yl-1,3-thiazol-4-yl)methyl]carbamoyl]amino]butanoyl]amino]-1,6-diphenylhexan-2-yl]carbamate
Also Known As: ritonavir, Ritonavir-d6, Norvir, Ritonavir?, Ritonavir-13C3
Top 5 of 4 IPC patent classification(s) from the SureChEMBL global patent database.
| Molecular Formula | C37H48N6O5S2 |
| Molecular Weight | 720.31274 g/mol |
| XLogP | 6.0 |
| Topological Polar Surface Area (TPSA) | 202.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 18 |
| Exact Mass | 720.31274 Da |
| Heavy Atoms | 50 |
| Complexity | 1040.0 |
| SMILES | CC(C)C1=NC(=CS1)CN(C)C(=O)NC(C(C)C)C(=O)NC(CC2=CC=CC=C2)CC(C(CC3=CC=CC=C3)NC(=O)OCC4=CN=CS4)O |
| InChIKey | NCDNCNXCDXHOMX-UHFFFAOYSA-N |
The XLogP value of 6.0 indicates that ritonavir is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 202.0 Ų indicates high polarity, suggesting ritonavir may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, ritonavir has 4 hydrogen bond donor(s) and 9 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
The CAS number of ritonavir is 155213-67-5.
The molecular formula of ritonavir is C37H48N6O5S2.
The molecular weight of ritonavir is 720.31274 g/mol.
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