Alanine, N-((4-(bis(2-chloroethyl)amino)phenyl)acetyl)-3-(p-chlorophenyl)-, DL-
TL;DR: Alanine, N-((4-(bis(2-chloroethyl)amino)phenyl)acetyl)-3-(p-chlorophenyl)-, DL- (CAS 55327-81-6) is a chemical compound with molecular formula C21H23Cl3N2O3 and molecular weight 456.07742 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-[[2-[4-[bis(2-chloroethyl)amino]phenyl]acetyl]amino]-3-(4-chlorophenyl)propanoic acid
Also Known As: BAS 00535269, N-(4-Di-(2-chloroethyl)aminophenylacetyl)-DL-p-chlorophenylalanine, DL-N-((4-(Bis(2-chloroethyl)amino)phenyl)acetyl)-3-(p-chlorophenyl)alanine, DL-Phenylalanine, N-((4-(bis(2-chloroethyl)amino)phenyl)acetyl)-4-chloro-, ALANINE, N-((4-(BIS(2-CHLOROETHYL)AMINO)PHENYL)ACETYL)-3-(p-CHLOROPHENYL)-, DL-
Technical Specifications
| Molecular Formula | C21H23Cl3N2O3 |
| Molecular Weight | 456.07742 g/mol |
| XLogP | 4.7 |
| Topological Polar Surface Area (TPSA) | 69.6 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 11 |
| Exact Mass | 456.07742 Da |
| Heavy Atoms | 29 |
| Complexity | 501.0 |
| SMILES | C1=CC(=CC=C1CC(C(=O)O)NC(=O)CC2=CC=C(C=C2)N(CCCl)CCCl)Cl |
| InChIKey | XJRKDTNXNNSYTM-UHFFFAOYSA-N |
Chemical Property Profile of Alanine, N-((4-(bis(2-chloroethyl)amino)phenyl)acetyl)-3-(p-chlorophenyl)-, DL-
Property Insights of Alanine, N-((4-(bis(2-chloroethyl)amino)phenyl)acetyl)-3-(p-chlorophenyl)-, DL-
The XLogP value of 4.7 indicates that Alanine, N-((4-(bis(2-chloroethyl)amino)phenyl)acetyl)-3-(p-chlorophenyl)-, DL- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 69.6 Ų falls within the moderate polarity range, balancing permeability and solubility for Alanine, N-((4-(bis(2-chloroethyl)amino)phenyl)acetyl)-3-(p-chlorophenyl)-, DL-. Following Lipinski's Rule of Five, Alanine, N-((4-(bis(2-chloroethyl)amino)phenyl)acetyl)-3-(p-chlorophenyl)-, DL- 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 Alanine, N-((4-(bis(2-chloroethyl)amino)phenyl)acetyl)-3-(p-chlorophenyl)-, DL-?
The CAS number of Alanine, N-((4-(bis(2-chloroethyl)amino)phenyl)acetyl)-3-(p-chlorophenyl)-, DL- is 55327-81-6.
What is the molecular formula of Alanine, N-((4-(bis(2-chloroethyl)amino)phenyl)acetyl)-3-(p-chlorophenyl)-, DL-?
The molecular formula of Alanine, N-((4-(bis(2-chloroethyl)amino)phenyl)acetyl)-3-(p-chlorophenyl)-, DL- is C21H23Cl3N2O3.
What is the molecular weight of Alanine, N-((4-(bis(2-chloroethyl)amino)phenyl)acetyl)-3-(p-chlorophenyl)-, DL-?
The molecular weight of Alanine, N-((4-(bis(2-chloroethyl)amino)phenyl)acetyl)-3-(p-chlorophenyl)-, DL- is 456.07742 g/mol.
Where can I buy Alanine, N-((4-(bis(2-chloroethyl)amino)phenyl)acetyl)-3-(p-chlorophenyl)-, DL-?
You can request a quote for Alanine, N-((4-(bis(2-chloroethyl)amino)phenyl)acetyl)-3-(p-chlorophenyl)-, DL- directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Alanine, N-((4-(bis(2-chloroethyl)amino)phenyl)acetyl)-3-(p-chlorophenyl)-, DL-?
Yes, CoreyChem provides custom synthesis services for Alanine, N-((4-(bis(2-chloroethyl)amino)phenyl)acetyl)-3-(p-chlorophenyl)-, DL- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.