N-(Hexahydro-1-methyl-2H-azepin-2-ylidene)-L-cysteine
TL;DR: N-(Hexahydro-1-methyl-2H-azepin-2-ylidene)-L-cysteine (CAS 105099-14-7) is a chemical compound with molecular formula C10H18N2O2S and molecular weight 230.1089 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(2R)-2-[(1-methylazepan-2-ylidene)amino]-3-sulfanylpropanoic acid
Also Known As: N-(Hexahydro-1-methyl-2H-azepin-2-ylidene)-L-cysteine, L-Cysteine, N-(hexahydro-1-methyl-2H-azepin-2-ylidene)-, L-Cysteine,N-(hexahydro-1-methyl-2H-azepin-2-ylidene)-, (2R)-2-[(1-methylazepan-2-ylidene)amino]-3-sulfanylpropanoic acid, BRN 5533184
Technical Specifications
| Molecular Formula | C10H18N2O2S |
| Molecular Weight | 230.1089 g/mol |
| XLogP | 0.7 |
| Topological Polar Surface Area (TPSA) | 53.9 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 230.1089 Da |
| Heavy Atoms | 15 |
| Complexity | 256.0 |
| SMILES | CN1CCCCCC1=N[C@@H](CS)C(=O)O |
| InChIKey | YWCBQQIRMJYFHS-QMMMGPOBSA-N |
Chemical Property Profile of N-(Hexahydro-1-methyl-2H-azepin-2-ylidene)-L-cysteine
Property Insights of N-(Hexahydro-1-methyl-2H-azepin-2-ylidene)-L-cysteine
The XLogP value of 0.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-(Hexahydro-1-methyl-2H-azepin-2-ylidene)-L-cysteine. With a topological polar surface area (TPSA) of 53.9 Ų, N-(Hexahydro-1-methyl-2H-azepin-2-ylidene)-L-cysteine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-(Hexahydro-1-methyl-2H-azepin-2-ylidene)-L-cysteine has 2 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of N-(Hexahydro-1-methyl-2H-azepin-2-ylidene)-L-cysteine?
The CAS number of N-(Hexahydro-1-methyl-2H-azepin-2-ylidene)-L-cysteine is 105099-14-7.
What is the molecular formula of N-(Hexahydro-1-methyl-2H-azepin-2-ylidene)-L-cysteine?
The molecular formula of N-(Hexahydro-1-methyl-2H-azepin-2-ylidene)-L-cysteine is C10H18N2O2S.
What is the molecular weight of N-(Hexahydro-1-methyl-2H-azepin-2-ylidene)-L-cysteine?
The molecular weight of N-(Hexahydro-1-methyl-2H-azepin-2-ylidene)-L-cysteine is 230.1089 g/mol.
Where can I buy N-(Hexahydro-1-methyl-2H-azepin-2-ylidene)-L-cysteine?
You can request a quote for N-(Hexahydro-1-methyl-2H-azepin-2-ylidene)-L-cysteine directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for N-(Hexahydro-1-methyl-2H-azepin-2-ylidene)-L-cysteine?
Yes, CoreyChem provides custom synthesis services for N-(Hexahydro-1-methyl-2H-azepin-2-ylidene)-L-cysteine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.