methyl 3-(2-{[2-(1H-indol-3-yl)ethyl]amino}-2-oxoethyl)-5-(3-methoxyphenyl)-7-methyl-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Chemical Structure Depiction of
methyl 3-(2-{[2-(1H-indol-3-yl)ethyl]amino}-2-oxoethyl)-5-(3-methoxyphenyl)-7-methyl-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
methyl 3-(2-{[2-(1H-indol-3-yl)ethyl]amino}-2-oxoethyl)-5-(3-methoxyphenyl)-7-methyl-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Compound characteristics
| Compound ID: | V016-6259 |
| Compound Name: | methyl 3-(2-{[2-(1H-indol-3-yl)ethyl]amino}-2-oxoethyl)-5-(3-methoxyphenyl)-7-methyl-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate |
| Molecular Weight: | 516.62 |
| Molecular Formula: | C28 H28 N4 O4 S |
| Smiles: | CC1=C(C(c2cccc(c2)OC)N2C(CC(NCCc3c[nH]c4ccccc34)=O)=CSC2=N1)C(=O)OC |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.7423 |
| logD: | 3.7417 |
| logSw: | -4.2231 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 74.286 |
| InChI Key: | ACZVOCDJJQBIJA-AREMUKBSSA-N |