N-[(1R,2S)-1-[1-(4-fluorophenyl)indazol-5-yl]oxy-1-(3-methoxyphenyl)propan-2-yl]-3-methyl-thiophene-2-carboxamide (HCID 59339782)

기본 정보

표준 SMILES: COc1cccc([C@@H](Oc2ccc3c(cnn3-c3ccc(F)cc3)c2)[C@H](C)NC(=O)c2sccc2C)c1
InChIKey: VKAYQWFPVOCYJI-PPHZAIPVSA-N
분자식: C29H26FN3O3S
평균 분자량: 515.6 g/mol

이름 및 식별자

우선 이름: N-[(1R,2S)-1-[1-(4-fluorophenyl)indazol-5-yl]oxy-1-(3-methoxyphenyl)propan-2-yl]-3-methyl-thiophene-2-carboxamide
IUPAC: N-[(1R,2S)-1-[1-(4-fluorophenyl)indazol-5-yl]oxy-1-(3-methoxyphenyl)propan-2-yl]-3-methylthiophene-2-carboxamide

이름 및 동의어

SCHEMBL835026VKAYQWFPVOCYJI-PPHZAIPVSA-NN-[(1R,2S)-1-[1-(4-fluorophenyl)indazol-5-yl]oxy-1-(3-methoxyphenyl)propan-2-yl]-3-methyl-thiophene-2-carboxamidN-[(1R,2S)-1-[1-(4-fluorophenyl)indazol-5-yl]oxy-1-(3-methoxyphenyl)propan-2-yl]-3-methyl-thiophene-2-carboxamide

데이터베이스 식별자

PubChem CID: 59339782

물성

구조 계산 물성

XLogP: 6.6
극성 표면적: 93.6 Å²
수소 결합 공여자 수: 1
수소 결합 수용자 수: 6
회전 가능 결합 수: 8
무거운 원자 수: 37
형식 전하: 0
복잡도: 754

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