TL;DR: Statine deriv. (CAS 161594-18-9) is a chemical compound with molecular formula C41H49N5O6 and molecular weight 707.3683 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
benzyl N-[(2S)-1-[[(2S,3R,4R)-4-(benzylamino)-5-[[(2S)-1-(benzylamino)-3-methyl-1-oxobutan-2-yl]amino]-3-hydroxy-5-oxo-1-phenylpentan-2-yl]amino]-1-oxopropan-2-yl]carbamate
Also Known As: Statine deriv., Statine deriv. 19, Tle-Val-Sta, 5PhBuCOOH deriv., Ala-Val-Sta, 5PhBuCOOH deriv.
| Molecular Formula | C41H49N5O6 |
| Molecular Weight | 707.3683 g/mol |
| XLogP | 5.2 |
| Topological Polar Surface Area (TPSA) | 158.0 Ų |
| Hydrogen Bond Donors | 6 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 19 |
| Exact Mass | 707.3683 Da |
| Heavy Atoms | 52 |
| Complexity | 1080.0 |
| SMILES | C[C@@H](C(=O)N[C@@H](CC1=CC=CC=C1)[C@H]([C@H](C(=O)N[C@@H](C(C)C)C(=O)NCC2=CC=CC=C2)NCC3=CC=CC=C3)O)NC(=O)OCC4=CC=CC=C4 |
| InChIKey | DCQDUHWLKDMVNO-QRXXMQSMSA-N |
The XLogP value of 5.2 indicates that Statine deriv. is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 158.0 Ų indicates high polarity, suggesting Statine deriv. may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Statine deriv. has 6 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
The CAS number of Statine deriv. is 161594-18-9.
The molecular formula of Statine deriv. is C41H49N5O6.
The molecular weight of Statine deriv. is 707.3683 g/mol.
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