TL;DR: Neoprontosil (CAS 132-38-7) is a chemical compound with molecular formula C18H16N4O10S3 and molecular weight 544.00287 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
6-acetamido-4-hydroxy-3-[(4-sulfamoylphenyl)diazenyl]naphthalene-2,7-disulfonic acid
Also Known As: Neoprontosil, Neoprontsil, AZOSULFAMIDE, Drometil, Neo-prontosil
| Molecular Formula | C18H16N4O10S3 |
| Molecular Weight | 544.00287 g/mol |
| XLogP | 0.4 |
| Topological Polar Surface Area (TPSA) | 268.0 Ų |
| Hydrogen Bond Donors | 5 |
| Hydrogen Bond Acceptors | 13 |
| Rotatable Bonds | 6 |
| Exact Mass | 544.00287 Da |
| Heavy Atoms | 35 |
| Complexity | 1130.0 |
| SMILES | CC(=O)NC1=C(C=C2C=C(C(=C(C2=C1)O)N=NC3=CC=C(C=C3)S(=O)(=O)N)S(=O)(=O)O)S(=O)(=O)O |
| InChIKey | RALNLQYPLYWQRT-UHFFFAOYSA-N |
The XLogP value of 0.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Neoprontosil. The TPSA of 268.0 Ų indicates high polarity, suggesting Neoprontosil may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Neoprontosil has 5 hydrogen bond donor(s) and 13 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
The CAS number of Neoprontosil is 132-38-7.
The molecular formula of Neoprontosil is C18H16N4O10S3.
The molecular weight of Neoprontosil is 544.00287 g/mol.
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