4-Methoxy-7-morpholinobenzo[d]thiazol-2-amine

Cat. No.: PI383865574

Product Details Other Identifiers Computed Properties

CAS	383865-57-4
Purity	95%
Molecular Formula	C12H15N3O2S
Molecular Weight	265.33
Molar Refractivity	76.24

Pubchem ID	11402861
InChI Key	DOIKFFGWUPLXGA-UHFFFAOYSA-N
MDL Number	MFCD18642707

Hydrogen Bond Donor Count	1.0
Hydrogen Bond Acceptor Count	3.0
Rotatable Bond Count	2
Topological Polar Surface Area	88.85 Å²
Heavy Atom Count	18
Aromatic Heavy Atoms Number	9
Fraction Csp3	0.42
Log Po/w (iLOGP)	2.18
Log Po/w (XLOGP3)	1.75
Log Po/w (WLOGP)	1.35
Log Po/w (MLOGP)	0.75
Log Po/w (SILICOS-IT)	2.33
Consensus Log Po/w	1.67
GI Absorption	High
BBB Permeant	No
P-gp Substrate	Yes
CYP1A2Inhibitor	Yes
CYP2C19Inhibitor	No
CYP2C9Inhibitor	No
CYP2D6Inhibitor	No
CYP3A4Inhibitor	No
Log Kp (Skin Permeation)	-6.68 cm/s
Lipinski	0.0
Ghose	None
Veber	0.0
Egan	0.0
Muegge	0.0
Bioavailability Score	0.55
PAINS	1.0 alert
Brenk	0.0 alert
Leadlikeness	0.0
Synthetic Accessibility	2.84

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