IUPAC name
1-methylethyl N-(3,4-diethoxyphenyl)carbamate
SMILES
CCOc1ccc(cc1OCC)NC(=O)OC(C)C
Compound class
Fungicide
Therapeutic area
Fungicide
Common name
diethofencarb
IUPAC name
1-methylethyl N-(3,4-diethoxyphenyl)carbamate
SMILES
CCOc1ccc(cc1OCC)NC(=O)OC(C)C
INCHI
InChI=1S/C14H21NO4/c1-5-17-12-8-7-11(9-13(12)18-6-2)15-14(16)19-10(3)4/h7-10H,5-6H2,1-4H3,(H,15,16)
FORMULA
C14H21NO4
Common name
diethofencarb
IUPAC name
1-methylethyl N-(3,4-diethoxyphenyl)carbamate
Molecular weight
267.321
clogP
2.839
clogS
-3.092
HBond Acceptor
5
HBond Donor
1
Total Polar Surface Area
60.28
Number of Rings
1
Rotatable Bond
7
| Drug ID | Common name | Structure CAS | SMILE | Frequency |
|---|---|---|---|---|
| FDBF00007 | propane |
|
C(C)C | 0.2412 |
| FDBF00041 | ethanol |
|
CCO | 0.1474 |
| FDBF00042 | propan-2-ol |
|
CC(O)C | 0.0278 |
| FDBF03690 | N-(3-hydroxyphenyl)formamide |
|
c1ccc(cc1NC=O)O | 0.0014 |
| FDBF06401 | propan-2-yl N-phenylcarbamate |
|
O(C(C)C)C(=O)Nc1ccccc1 | 0.0007 |
| FDBF06957 | isopropyl (4-hydroxyphenyl)carbamate |
|
c1(ccc(cc1)NC(=O)OC(C)C)O | 0.0003 |
| FDBF06959 | isopropyl (3-hydroxyphenyl)carbamate |
|
c1c(cc(cc1)NC(=O)OC(C)C)O | 0.0003 |
| FDBF06960 | (3-ethoxyphenyl)carbamic acid |
|
c1c(cc(cc1)NC(=O)O)OCC | 0.0003 |
13 ,
2
