TL;DR: Lysyl-histidyl-phenylalanyl-arginyl-tryptophyl-glycinamide (CAS 124051-38-3) is a chemical compound with molecular formula C40H56N14O6 and molecular weight 828.45074 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(2S)-2,6-diamino-N-[(2S)-1-[[(2S)-1-[[(2S)-1-[[(2S)-1-[(2-amino-2-oxoethyl)amino]-3-(1H-indol-3-yl)-1-oxopropan-2-yl]amino]-5-(diaminomethylideneamino)-1-oxopentan-2-yl]amino]-1-oxo-3-phenylpropan-2-yl]amino]-3-(4H-imidazol-4-yl)-1-oxopropan-2-yl]hexanamide
Also Known As: Khfrwg-NH2, Lys-his-phe-arg-trp-gly-NH2, Lysyl-histidyl-phenylalanyl-arginyl-tryptophyl-glycinamide, (2S)-2,6-diamino-N-[(2S)-1-[[(2S)-1-[[(2S)-1-[[(2S)-1-[(2-amino-2-oxoethyl)amino]-3-(1H-indol-3-yl)-1-oxopropan-2-yl]amino]-5-(diaminomethylideneamino)-1-oxopentan-2-yl]amino]-1-oxo-3-phenylpropan-2-yl]amino]-3-(4H-imidazol-4-yl)-1-oxopropan-2-yl]hexanamide, (5S,8S,11S,14S,17S)-17,21-Diamino-11-benzyl-8-[3-(carbamimidoylamino)propyl]-4,7,10,13,16-pentahydroxy-14-[(4H-imidazol-4-yl)methyl]-5-[(1H-indol-3-yl)methyl]-3,6,9,12,15-pentaazahenicosa-3,6,9,12,15-pentaen-1-imidic acid
| Molecular Formula | C40H56N14O6 |
| Molecular Weight | 828.45074 g/mol |
| XLogP | -1.9 |
| Topological Polar Surface Area (TPSA) | 346.0 Ų |
| Hydrogen Bond Donors | 11 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 25 |
| Exact Mass | 828.45074 Da |
| Heavy Atoms | 60 |
| Complexity | 1530.0 |
| SMILES | C1=CC=C(C=C1)C[C@@H](C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](CC2=CNC3=CC=CC=C32)C(=O)NCC(=O)N)NC(=O)[C@H](CC4C=NC=N4)NC(=O)[C@H](CCCCN)N |
| InChIKey | GCUIUNOPGLCPEK-IUUMMYRWSA-N |
The XLogP value of -1.9 indicates that Lysyl-histidyl-phenylalanyl-arginyl-tryptophyl-glycinamide is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 346.0 Ų indicates high polarity, suggesting Lysyl-histidyl-phenylalanyl-arginyl-tryptophyl-glycinamide may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Lysyl-histidyl-phenylalanyl-arginyl-tryptophyl-glycinamide has 11 hydrogen bond donor(s) and 10 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
The CAS number of Lysyl-histidyl-phenylalanyl-arginyl-tryptophyl-glycinamide is 124051-38-3.
The molecular formula of Lysyl-histidyl-phenylalanyl-arginyl-tryptophyl-glycinamide is C40H56N14O6.
The molecular weight of Lysyl-histidyl-phenylalanyl-arginyl-tryptophyl-glycinamide is 828.45074 g/mol.
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