TL;DR: SC 50605 (CAS 138828-39-4) is a chemical compound with molecular formula C30H35NO6S and molecular weight 537.2185 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
7-[3-[2-(cyclopropylmethyl)-3-methoxy-4-(1,3-thiazol-4-yl)phenoxy]propoxy]-8-propyl-3,4-dihydro-2H-chromene-2-carboxylic acid
Also Known As: SC 50605, 7-[3-[2-(cyclopropylmethyl)-3-methoxy-4-(1,3-thiazol-4-yl)phenoxy]propoxy]-8-propyl-3,4-dihydro-2H-chromene-2-carboxylic acid, 2H-1-Benzopyran-2-carboxylic acid, 7-(3-(2-(cyclopropylmethyl)-3-methoxy-4-(4-thiazolyl)phenoxy)propoxy)-3,4-dihydro-8-propyl-, 7-(3-(3-Methoxy-2-(cyclopropylmethyl)-4-(4-thiazolyl)phenoxy)propoxy)-3,4-dihydro-8-propyl-2H-1-benzopyran-2-carboxylic acid, 7-(3-(2-(cyclopropylmethyl)-3-methoxy-4-(thiazol-4-yl)phenoxy)propoxy)-8-propylchromane-2-carboxylic acid
Top 5 of 2 IPC patent classification(s) from the SureChEMBL global patent database.
| Molecular Formula | C30H35NO6S |
| Molecular Weight | 537.2185 g/mol |
| XLogP | 7.3 |
| Topological Polar Surface Area (TPSA) | 115.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 13 |
| Exact Mass | 537.2185 Da |
| Heavy Atoms | 38 |
| Complexity | 752.0 |
| SMILES | CCCC1=C(C=CC2=C1OC(CC2)C(=O)O)OCCCOC3=C(C(=C(C=C3)C4=CSC=N4)OC)CC5CC5 |
| InChIKey | NFHKAMAWIQHXAT-UHFFFAOYSA-N |
The XLogP value of 7.3 indicates that SC 50605 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 115.0 Ų falls within the moderate polarity range, balancing permeability and solubility for SC 50605. Following Lipinski's Rule of Five, SC 50605 has 1 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
The CAS number of SC 50605 is 138828-39-4.
The molecular formula of SC 50605 is C30H35NO6S.
The molecular weight of SC 50605 is 537.2185 g/mol.
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