Carbamic acid, (1-methylethyl)-, ((10H-phenothiazin-10-ylcarbonyl)imino)di-2,1-ethanediyl ester
Basic information
- CAS
65241-00-1- Standard SMILES
CC(C)NC(=O)OCCN(CCOC(=O)NC(C)C)C(=O)N1c2ccccc2Sc2ccccc21- InChIKey
YUBPQKBFOJVIHN-UHFFFAOYSA-N- Molecular formula
- C25H32N4O5S
- Average molar mass
- 500.6 g/mol
- Monoisotopic mass
- 500.20934131
Names & identifiers
- Preferred name
- Carbamic acid, (1-methylethyl)-, ((10H-phenothiazin-10-ylcarbonyl)imino)di-2,1-ethanediyl ester
- IUPAC
- 2-[phenothiazine-10-carbonyl-[2-(propan-2-ylcarbamoyloxy)ethyl]amino]ethyl N-propan-2-ylcarbamate
- English name
- Bis(1-methylethylcarbamic acid)2,2'-(10H-phenothiazin-10-ylcarbonylimino)diethyl ester
- Molecular formula
- C25H32N4O5S
- Molecular weight
- 500.61
Names & synonyms
BRN 1194717Carbamic acid, (1-methylethyl)-, ((10H-phenothiazin-10-ylcarbonyl)imino)di-2,1-ethanediyl ester65241-00-1(1-Methylethyl)carbamic acid ((10H-phenothiazin-10-ylcarbonyl)imino)di-2,1-ethanediyl esterDTXSID10215547RefChem:331778DTXCID40138038[(10H-Phenothiazine-10-carbonyl)azanediyl]di(ethane-2,1-diyl) bis(propan-2-ylcarbamate)Bis(1-methylethylcarbamic acid)2,2'-(10H-phenothiazin-10-ylcarbonylimino)diethyl esterCarbamic acid, (1-methylethyl)-, [(10H-phenothiazin-10-ylcarbonyl)imino]di-2,1-ethanediyl ester (9CI)
Database identifiers
- CAS
65241-00-1- PubChem CID
- 47562
- DTXSID
DTXSID10215547- Nikkaji
- J67.094D
Properties
Computed structural properties
- XLogP
- 4
- Topological polar surface area
- 126 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 10
- Heavy atoms
- 35
- Formal charge
- 0
- Complexity
- 672
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Compound notes
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