Ro 24-7429
7-chloro-N-methyl-5-(1H-pyrrol-2-yl)-1,3-dihydro-1,4-benzodiazepin-2-imine
Molecular Identity
Ro 24-7429
7-chloro-N-methyl-5-(1H-pyrrol-2-yl)-1,3-dihydro-1,4-benzodiazepin-2-imine
PubChem CID: 135422895
7-chloro-N-methyl-5-(1H-pyrrol-2-yl)-3H-1,4-benzodiazepin-2-amine is a benzodiazepine.
2D Structure
Properties
C14H13ClN4
Molecular Formula
272.73
Molecular Weight
g/mol
272.0829
Exact Mass
Da
2.3
XLogP
Drug-like (Lipinski: < 5)
52.5
TPSA
Good oral absorption (< 140 A²)
2
H-Bond Donors
2
H-Bond Acceptors
393
Complexity
SMILES
Canonical SMILES
SMILES: CN=C1CN=C(C2=C(N1)C=CC(=C2)Cl)C3=CC=CN3Isomeric SMILES
SMILES: CN=C1CN=C(C2=C(N1)C=CC(=C2)Cl)C3=CC=CN3Synonyms(20)
139339-45-0Ro 24-7429Ro-24-7429MLW2GKK8LI3H-1,4-Benzodiazepin-2-amine, 7-chloro-N-methyl-5-(1H-pyrrol-2-yl)-DTXSID20161021RefChem:179653DTXCID3083512Ro24-74297-Chloro-N-methyl-5-(1H-pyrrol-2-yl)-3H-1,4-benzodiazepin-2-amine7-chloro-N-methyl-5-(1H-pyrrol-2-yl)-1,3-dihydro-1,4-benzodiazepin-2-imineTOPOTECAN(TPT)Fluorescent brightener 151UNII-MLW2GKK8LI12224-16-7
Data from PubChem (NCBI)
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Drug Network
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