TL;DR: Pro-His-Ser-Arg-Asn (CAS 158622-13-0) is a chemical compound with molecular formula C24H39N11O8 and molecular weight 609.2983 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(2S)-4-amino-2-[[(2S)-5-(diaminomethylideneamino)-2-[[(2S)-3-hydroxy-2-[[(2S)-3-(1H-imidazol-5-yl)-2-[[(2S)-pyrrolidine-2-carbonyl]amino]propanoyl]amino]propanoyl]amino]pentanoyl]amino]-4-oxobutanoic acid
Also Known As: Pro-His-Ser-Arg-Asn, Fibronectin Fragment (1376-1380), J1.500.991H, (2S)-2-[(2S)-5-carbamimidamido-2-[(2S)-3-hydroxy-2-[(2S)-3-(1H-imidazol-4-yl)-2-{[(2S)-pyrrolidin-2-yl]formamido}propanamido]propanamido]pentanamido]-3-carbamoylpropanoic acid
| Molecular Formula | C24H39N11O8 |
| Molecular Weight | 609.2983 g/mol |
| XLogP | -7.4 |
| Topological Polar Surface Area (TPSA) | 322.0 Ų |
| Hydrogen Bond Donors | 11 |
| Hydrogen Bond Acceptors | 11 |
| Rotatable Bonds | 18 |
| Exact Mass | 609.2983 Da |
| Heavy Atoms | 43 |
| Complexity | 1040.0 |
| SMILES | C1C[C@H](NC1)C(=O)N[C@@H](CC2=CN=CN2)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](CC(=O)N)C(=O)O |
| InChIKey | RQCGTOIANNRVRQ-WOYTXXSLSA-N |
The XLogP value of -7.4 indicates that Pro-His-Ser-Arg-Asn is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 322.0 Ų indicates high polarity, suggesting Pro-His-Ser-Arg-Asn may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Pro-His-Ser-Arg-Asn has 11 hydrogen bond donor(s) and 11 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
The CAS number of Pro-His-Ser-Arg-Asn is 158622-13-0.
The molecular formula of Pro-His-Ser-Arg-Asn is C24H39N11O8.
The molecular weight of Pro-His-Ser-Arg-Asn is 609.2983 g/mol.
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