N-(10-benzyl-11-oxo-10,11-dihydrodibenzo[b,f][1,4]thiazepin-8-yl)-N'-[2-(cyclohex-1-en-1-yl)ethyl]urea
Chemical Structure Depiction of
N-(10-benzyl-11-oxo-10,11-dihydrodibenzo[b,f][1,4]thiazepin-8-yl)-N'-[2-(cyclohex-1-en-1-yl)ethyl]urea
N-(10-benzyl-11-oxo-10,11-dihydrodibenzo[b,f][1,4]thiazepin-8-yl)-N'-[2-(cyclohex-1-en-1-yl)ethyl]urea
Compound characteristics
| Compound ID: | C799-0069 |
| Compound Name: | N-(10-benzyl-11-oxo-10,11-dihydrodibenzo[b,f][1,4]thiazepin-8-yl)-N'-[2-(cyclohex-1-en-1-yl)ethyl]urea |
| Molecular Weight: | 483.63 |
| Molecular Formula: | C29 H29 N3 O2 S |
| Smiles: | C1CCC(CCNC(Nc2ccc3c(c2)N(Cc2ccccc2)C(c2ccccc2S3)=O)=O)=CC1 |
| Stereo: | ACHIRAL |
| logP: | 6.651 |
| logD: | 6.651 |
| logSw: | -6.0553 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 49.059 |
| InChI Key: | DBJJCIUFKDEUAU-UHFFFAOYSA-N |