TL;DR: L 739749 (CAS 156511-34-1) is a chemical compound with molecular formula C24H41N3O6S2 and molecular weight 531.24365 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
methyl (2S)-2-[[(2S)-2-[(2S,3S)-2-[[(2R)-2-amino-3-sulfanylpropyl]amino]-3-methylpentoxy]-3-phenylpropanoyl]amino]-4-methylsulfonylbutanoate
Also Known As: L-739749, L 739749, L-739,749, methyl (2S)-2-[[(2S)-2-[(2S,3S)-2-[[(2R)-2-amino-3-sulfanylpropyl]amino]-3-methylpentoxy]-3-phenylpropanoyl]amino]-4-methylsulfonylbutanoate, 2(S)-(2(S)-(2(R)-Amino-3-mercapto)propylamino-3(S)-methyl)pentyloxy-3-phenylpropionylmethioninesulfone methyl ester
Top 5 of 1 IPC patent classification(s) from the SureChEMBL global patent database.
| Molecular Formula | C24H41N3O6S2 |
| Molecular Weight | 531.24365 g/mol |
| XLogP | 1.8 |
| Topological Polar Surface Area (TPSA) | 146.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 18 |
| Exact Mass | 531.24365 Da |
| Heavy Atoms | 35 |
| Complexity | 725.0 |
| SMILES | CC[C@H](C)[C@@H](CO[C@@H](CC1=CC=CC=C1)C(=O)N[C@@H](CCS(=O)(=O)C)C(=O)OC)NC[C@H](CS)N |
| InChIKey | XDPAYLCHZOZGMW-NDYOWHOSSA-N |
The XLogP value of 1.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for L 739749. The TPSA of 146.0 Ų indicates high polarity, suggesting L 739749 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, L 739749 has 4 hydrogen bond donor(s) and 9 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
The CAS number of L 739749 is 156511-34-1.
The molecular formula of L 739749 is C24H41N3O6S2.
The molecular weight of L 739749 is 531.24365 g/mol.
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