leucinostatin A, hydrochloride
TL;DR: leucinostatin A, hydrochloride (CAS 78149-02-7) is a chemical compound with molecular formula C62H112ClN11O13 and molecular weight 1253.81 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[1-[[1-[[1-[[1-[[1-[[1-[[1-[[3-[1-(dimethylamino)propan-2-ylamino]-3-oxopropyl]amino]-2-methyl-1-oxopropan-2-yl]amino]-2-methyl-1-oxopropan-2-yl]amino]-4-methyl-1-oxopentan-2-yl]amino]-4-methyl-1-oxopentan-2-yl]amino]-2-methyl-1-oxopropan-2-yl]amino]-3-hydroxy-4-methyl-1-oxopentan-2-yl]amino]-6-hydroxy-4-methyl-1,8-dioxodecan-2-yl]-4-methyl-1-[(E)-4-methylhex-2-enoyl]pyrrolidine-2-carboxamide;hydrochloride
Also Known As: Leucinostatin A, hydrochloride, N-[1-[[1-[[1-[[1-[[1-[[1-[[1-[[3-[1-(dimethylamino)propan-2-ylamino]-3-oxopropyl]amino]-2-methyl-1-oxopropan-2-yl]amino]-2-methyl-1-oxopropan-2-yl]amino]-4-methyl-1-oxopentan-2-yl]amino]-4-methyl-1-oxopentan-2-yl]amino]-2-methyl-1-oxopropan-2-yl]amino]-3-hydroxy-4-methyl-1-oxopentan-2-yl]amino]-6-hydroxy-4-methyl-1,8-dioxodecan-2-yl]-4-methyl-1-[(E)-4-methylhex-2-enoyl]pyrrolidine-2-carboxamide;hydrochloride, N-[1-[[1-[[1-[[1-[[1-[[1-[[1-[[3-[1-(dimethylamino)propan-2-ylamino]-3-oxopropyl]amino]-2-methyl-1-oxopropan-2-yl]amino]-2-methyl-1-oxopropan-2-yl]amino]-4-methyl-1-oxopentan-2-yl]amino]-4-methyl-1-oxopentan-2-yl]amino]-2-methyl-1-oxopropan-2-yl]amino]-3-hydroxy-4-methyl-1-oxopentan-2-yl]amino]-6-hydroxy-4-methyl-1,8-dioxodecan-2-yl]-4-methyl-1-[(E)-4-methylhex-2-enoyl]pyrrolidine-2-carboxamide hydrochloride
| Molecular Formula | C62H112ClN11O13 |
|---|---|
| Molecular Weight | 1253.81 g/mol |
| LogP | 2.6992 |
| Topological Polar Surface Area | 342.98 Ų |
| Hydrogen Bond Donors | 11 |
| Hydrogen Bond Acceptors | 14 |
| Rotatable Bonds | 37 |
| Exact Mass | 1253.813 |
| Heavy Atoms | 87 |
| Complexity | 2345.2112 |
Chemical Identifiers
| CAS Number | 78149-02-7 |
|---|---|
| SMILES | CCC(C)/C=C/C(=O)N1CC(CC1C(=O)NC(CC(C)CC(CC(=O)CC)O)C(=O)NC(C(C(C)C)O)C(=O)NC(C)(C)C(=O)NC(CC(C)C)C(=O)NC(CC(C)C)C(=O)NC(C)(C)C(=O)NC(C)(C)C(=O)NCCC(=O)NC(C)CN(C)C)C.Cl |
Product Overview
leucinostatin A, hydrochloride (CAS 78149-02-7), with molecular formula C62H112ClN11O13 and molecular weight 1253.81 g/mol. IUPAC: N-[1-[[1-[[1-[[1-[[1-[[1-[[1-[[3-[1-(dimethylamino)propan-2-ylamino]-3-oxopropyl]amino]-2-methyl-1-oxopropan-2-yl]amino]-2-methyl-1-oxopropan-2-yl]amino]-4-methyl-1-oxopentan-2-yl]amino]-4-methyl-1-oxopentan-2-yl]amino]-2-methyl-1-oxopropan-2-yl]amino]-3-hydroxy-4-methyl-1-oxopentan-2-yl]amino]-6-hydroxy-4-methyl-1,8-dioxodecan-2-yl]-4-methyl-1-[(E)-4-methylhex-2-enoyl]pyrrolidine-2-carboxamide;hydrochloride.
Chemical Property Profile of leucinostatin A, hydrochloride
Property Insights of leucinostatin A, hydrochloride
The XLogP value of 2.6992 suggests moderate lipophilicity, balancing water solubility and membrane permeability for leucinostatin A, hydrochloride. The TPSA of 342.98 Ų indicates high polarity, suggesting leucinostatin A, hydrochloride may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, leucinostatin A, hydrochloride has 11 hydrogen bond donor(s) and 14 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of leucinostatin A, hydrochloride?
The CAS number of leucinostatin A, hydrochloride is 78149-02-7.
What is the molecular formula of leucinostatin A, hydrochloride?
The molecular formula of leucinostatin A, hydrochloride is C62H112ClN11O13.
What is the molecular weight of leucinostatin A, hydrochloride?
The molecular weight of leucinostatin A, hydrochloride is 1253.81 g/mol.
Where can I buy leucinostatin A, hydrochloride?
You can request a quote for leucinostatin A, hydrochloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for leucinostatin A, hydrochloride?
Yes, KEHONG BIO provides custom synthesis services for leucinostatin A, hydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.