3-(Ethoxycarbonylamino)phenothiazine - CAS 14966-87-1
Catalog: |
BB066168 |
Product Name: |
3-(Ethoxycarbonylamino)phenothiazine |
CAS: |
14966-87-1 |
Synonyms: |
3-(ETHOXYCARBONYLAMINO)PHENOTHIAZINE; Ethyl (10H-phenothiazin-3-yl)carbamate; ethyl N-(10H-phenothiazin-3-yl)carbamate; (10H-phenothiazin-3-yl)-carbamic acid ethyl ester; ethyl phenothiazine-3-carbamate |
IUPAC Name: | ethyl N-(10H-phenothiazin-3-yl)carbamate |
Molecular Weight: | 286.35 |
Molecular Formula: | C15H14N2O2S |
Canonical SMILES: | CCOC(=O)NC1=CC2=C(C=C1)NC3=CC=CC=C3S2 |
InChI: | InChI=1S/C15H14N2O2S/c1-2-19-15(18)16-10-7-8-12-14(9-10)20-13-6-4-3-5-11(13)17-12/h3-9,17H,2H2,1H3,(H,16,18) |
InChI Key: | LQXGFIZNOWLBEK-UHFFFAOYSA-N |
Complexity: | 353 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 286.07759887 |
Formal Charge: | 0 |
Heavy Atom Count: | 20 |
Hydrogen Bond Acceptor Count: | 4 |
Hydrogen Bond Donor Count: | 2 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 286.07759887 |
Rotatable Bond Count: | 3 |
Topological Polar Surface Area: | 75.7Ų |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 3.6 |
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