TL;DR: p-(p-Guanidinobenzoyloxy)phenyl acetic acid, N,N-dimethylcarbamoylmethyl ester (CAS 59721-29-8) is a chemical compound with molecular formula C21H26N4O8S and molecular weight 494.14713 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
diaminomethylidene-[4-[4-[2-[2-(dimethylamino)-2-oxoethoxy]-2-oxoethyl]phenoxy]carbonylphenyl]azanium;methanesulfonate
Also Known As: Camostat mesylate, camostat mesilate, Foipan, Camostatmesilate, Camostat monomethanesulfonate
Top 5 of 9 IPC patent classification(s) from the SureChEMBL global patent database.
| Molecular Formula | C21H26N4O8S |
| Molecular Weight | 494.14713 g/mol |
| XLogP | -1.77 |
| Topological Polar Surface Area (TPSA) | 205.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 9 |
| Exact Mass | 494.14713 Da |
| Heavy Atoms | 34 |
| Complexity | 681.0 |
| SMILES | CN(C)C(=O)COC(=O)CC1=CC=C(C=C1)OC(=O)C2=CC=C(C=C2)[NH+]=C(N)N.CS(=O)(=O)[O-] |
| InChIKey | FSEKIHNIDBATFG-UHFFFAOYSA-N |
The XLogP value of -1.77 indicates that p-(p-Guanidinobenzoyloxy)phenyl acetic acid, N,N-dimethylcarbamoylmethyl ester is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 205.0 Ų indicates high polarity, suggesting p-(p-Guanidinobenzoyloxy)phenyl acetic acid, N,N-dimethylcarbamoylmethyl ester may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, p-(p-Guanidinobenzoyloxy)phenyl acetic acid, N,N-dimethylcarbamoylmethyl ester has 3 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of p-(p-Guanidinobenzoyloxy)phenyl acetic acid, N,N-dimethylcarbamoylmethyl ester is 59721-29-8.
The molecular formula of p-(p-Guanidinobenzoyloxy)phenyl acetic acid, N,N-dimethylcarbamoylmethyl ester is C21H26N4O8S.
The molecular weight of p-(p-Guanidinobenzoyloxy)phenyl acetic acid, N,N-dimethylcarbamoylmethyl ester is 494.14713 g/mol.
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