![(S)-methyl 2-(3-(4-(benzo[d]thiazol-2-yl)phenyl)ureido)propanoate structure](/static/products/117/1173682-29-5.webp)
(S)-methyl 2-(3-(4-(benzo[d]thiazol-2-yl)phenyl)ureido)propanoate
TL;DR: (S)-methyl 2-(3-(4-(benzo[d]thiazol-2-yl)phenyl)ureido)propanoate (CAS 1173682-29-5) is a chemical compound with molecular formula C18H17N3O3S and molecular weight 355.09906 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
methyl (2S)-2-[[4-(1,3-benzothiazol-2-yl)phenyl]carbamoylamino]propanoate
Also Known As: (S)-methyl 2-(3-(4-(benzo[d]thiazol-2-yl)phenyl)ureido)propanoate, methyl N-{[4-(1,3-benzothiazol-2-yl)phenyl]carbamoyl}-L-alaninate, methyl (2S)-2-[[4-(1,3-benzothiazol-2-yl)phenyl]carbamoylamino]propanoate
Technical Specifications
| Molecular Formula | C18H17N3O3S |
| Molecular Weight | 355.09906 g/mol |
| XLogP | 3.6 |
| Topological Polar Surface Area (TPSA) | 109.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 355.09906 Da |
| Heavy Atoms | 25 |
| Complexity | 482.0 |
| SMILES | C[C@@H](C(=O)OC)NC(=O)NC1=CC=C(C=C1)C2=NC3=CC=CC=C3S2 |
| InChIKey | CCGQLMLFUMLXAA-NSHDSACASA-N |
Chemical Property Profile of (S)-methyl 2-(3-(4-(benzo[d]thiazol-2-yl)phenyl)ureido)propanoate
Property Insights of (S)-methyl 2-(3-(4-(benzo[d]thiazol-2-yl)phenyl)ureido)propanoate
The XLogP value of 3.6 indicates that (S)-methyl 2-(3-(4-(benzo[d]thiazol-2-yl)phenyl)ureido)propanoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 109.0 Ų falls within the moderate polarity range, balancing permeability and solubility for (S)-methyl 2-(3-(4-(benzo[d]thiazol-2-yl)phenyl)ureido)propanoate. Following Lipinski's Rule of Five, (S)-methyl 2-(3-(4-(benzo[d]thiazol-2-yl)phenyl)ureido)propanoate has 2 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of (S)-methyl 2-(3-(4-(benzo[d]thiazol-2-yl)phenyl)ureido)propanoate?
The CAS number of (S)-methyl 2-(3-(4-(benzo[d]thiazol-2-yl)phenyl)ureido)propanoate is 1173682-29-5.
What is the molecular formula of (S)-methyl 2-(3-(4-(benzo[d]thiazol-2-yl)phenyl)ureido)propanoate?
The molecular formula of (S)-methyl 2-(3-(4-(benzo[d]thiazol-2-yl)phenyl)ureido)propanoate is C18H17N3O3S.
What is the molecular weight of (S)-methyl 2-(3-(4-(benzo[d]thiazol-2-yl)phenyl)ureido)propanoate?
The molecular weight of (S)-methyl 2-(3-(4-(benzo[d]thiazol-2-yl)phenyl)ureido)propanoate is 355.09906 g/mol.
Where can I buy (S)-methyl 2-(3-(4-(benzo[d]thiazol-2-yl)phenyl)ureido)propanoate?
You can request a quote for (S)-methyl 2-(3-(4-(benzo[d]thiazol-2-yl)phenyl)ureido)propanoate directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for (S)-methyl 2-(3-(4-(benzo[d]thiazol-2-yl)phenyl)ureido)propanoate?
Yes, CoreyChem provides custom synthesis services for (S)-methyl 2-(3-(4-(benzo[d]thiazol-2-yl)phenyl)ureido)propanoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.