N-[4-(methylamino)-2-oxo-2H-1-benzopyran-3-yl]-N'-(3-methylbutyl)urea
Chemical Structure Depiction of
N-[4-(methylamino)-2-oxo-2H-1-benzopyran-3-yl]-N'-(3-methylbutyl)urea
N-[4-(methylamino)-2-oxo-2H-1-benzopyran-3-yl]-N'-(3-methylbutyl)urea
Compound characteristics
| Compound ID: | F129-0061 |
| Compound Name: | N-[4-(methylamino)-2-oxo-2H-1-benzopyran-3-yl]-N'-(3-methylbutyl)urea |
| Molecular Weight: | 303.36 |
| Molecular Formula: | C16 H21 N3 O3 |
| Smiles: | CC(C)CCNC(NC1=C(c2ccccc2OC1=O)NC)=O |
| Stereo: | ACHIRAL |
| logP: | 1.9933 |
| logD: | 1.9705 |
| logSw: | -2.7328 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 65.953 |
| InChI Key: | QFVKHCDHSOHWTB-UHFFFAOYSA-N |