N-(3-chloro-4-methoxyphenyl)-2-[(5-methylthieno[2',3':4,5]pyrrolo[1,2-d][1,2,4]triazin-8-yl)sulfanyl]butanamide
Chemical Structure Depiction of
N-(3-chloro-4-methoxyphenyl)-2-[(5-methylthieno[2',3':4,5]pyrrolo[1,2-d][1,2,4]triazin-8-yl)sulfanyl]butanamide
N-(3-chloro-4-methoxyphenyl)-2-[(5-methylthieno[2',3':4,5]pyrrolo[1,2-d][1,2,4]triazin-8-yl)sulfanyl]butanamide
Compound characteristics
| Compound ID: | E513-0919 |
| Compound Name: | N-(3-chloro-4-methoxyphenyl)-2-[(5-methylthieno[2',3':4,5]pyrrolo[1,2-d][1,2,4]triazin-8-yl)sulfanyl]butanamide |
| Molecular Weight: | 446.98 |
| Molecular Formula: | C20 H19 Cl N4 O2 S2 |
| Smiles: | CCC(C(Nc1ccc(c(c1)[Cl])OC)=O)Sc1c2cc3c(ccs3)n2c(C)nn1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.5991 |
| logD: | 4.5928 |
| logSw: | -4.7339 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 53.108 |
| InChI Key: | MOURHLNDTSRZTM-KRWDZBQOSA-N |